Leancare Ltd.

Web: http://www.leancare.co.uk
Address: Greenfield Business Centre. Greenfield. Holywell. Flintshire., Hollywell, Fintshire, United kingdom
Phone: +(44) 7587 049 029 | Fax: +(33) 494 863 170 | Map/Directions >>

Profile: Leancare Ltd. serves industries such as pharmaceutical and fine-chemical industries. Our product line includes bis(pinacolato)diboron, 3,4-ethylenedioxythiophene, fluoroquinolone intermediates, fluorobenzoic acid/fluoroaniline derivatives and malonyl dichloride. We supply vitamin B12, vitamin D3, beta-carotene (provitamin A, D-cycloserine and 6-fluoroindole. Our 2-deoxy-D-ribose is used in carbohydrate chemistry. Our 1-(1-naphthyl) ethylamine is an important reagent in amino-acid and peptide chemistry.

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• EDTA-Mn-Na2

IUPAC Name: disodium; 2-[2-[bis(carboxymethyl)amino]ethyl-(2-oxido-2-oxoethyl)amino]acetate; manganese | CAS Registry Number: 15375-84-5
Synonyms: EDTA, DISODIUM MANGANOUS SALT

Molecular Formula:	C₁₀H₁₄MnN₂Na₂O₈	Molecular Weight:	391.144349 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	10

InChIKey: BRTMCIOVDAIJSJ-UHFFFAOYSA-L

• Epinine Hcl

IUPAC Name: 4-[2-(methylamino)ethyl]benzene-1,2-diol hydrochloride | CAS Registry Number: 62-32-8
Synonyms: Ephinine hydrochloride, Epinine hydrochloride, EPININE HCl, Methyldopamine hydrochloride, N-Methyldopamine hydrochloride, Deoxyepinephrine hydrochloride, MLS000859907, MLS001332603, MLS001332604, D5886_SIGMA, N-Methyl- dopamine hydrochloride, EINECS 200-528-3, WLN: QR BQ D2M1 &GH, NSC 294897, CID86470, NSC294897, 3,4-Dihydroxyphenethylmethylammonium chloride, 3,4-Dihydroxyphenylethylmethylamine hydrochloride, 4-(2-Methylaminoethyl)pyrocatechol hydrochloride, NCGC00093818-01

Molecular Formula:	C₉H₁₄ClNO₂	Molecular Weight:	203.665960 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	3

InChIKey: JCDRZCWRRLKLTB-UHFFFAOYSA-N

• Ethoxyquin

IUPAC Name: 6-ethoxy-2,2,4-trimethyl-1H-quinoline | CAS Registry Number: 91-53-2
Synonyms: ethoxyquin, Santoquin, Ethoxyquine, Santoquine, Niflex, Antioxidant EC, Santoflex A, Santoflex AW, Stop-Scald, Dawe's nutrigard, Nix-Scald, Nocrack AW, Quinol ED, Aries Antox, Niflex D, Antage AW, Nocrac AW, Permanax 103, Alterungsschutzmittel EC, Ethoxyquin [ISO]

Molecular Formula:	C₁₄H₁₉NO	Molecular Weight:	217.306760 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: DECIPOUIJURFOJ-UHFFFAOYSA-N

• Ethyl (R)-4-Cyano-3-Hydroxybutanoate

IUPAC Name: ethyl (3R)-4-cyano-3-hydroxybutanoate | CAS Registry Number: 141942-85-0
Synonyms: 479772_ALDRICH, ZINC02562594, ZINC02567777, CID2733879, TL8006150, (R)-4-Cyano-3-hydroxybutyric acid ethyl ester, (R)-(−)-Ethyl 4-cyano-3-hydroxybutyrate, Ethyl (R)-(−)-4-cyano-3-hydroxybutyrate

Molecular Formula:	C₇H₁₁NO₃	Molecular Weight:	157.167140 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: LOQFROBMBSKWQY-ZCFIWIBFSA-N

• Ethyl (S)-4-Bromo-3-Hydroxybutanoate

IUPAC Name: ethyl (3S)-4-bromo-3-hydroxybutanoate | CAS Registry Number: 95537-36-3
Synonyms: 479608_ALDRICH, ZINC02567774, CID2733694, Ethyl (S)-(−)-4-bromo-3-hydroxybutyrate

Molecular Formula:	C₆H₁₁BrO₃	Molecular Weight:	211.053740 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: AIZRKZQHJNWBEI-YFKPBYRVSA-N

• Ethyl-(S)-nipecotate,L-tartrate

IUPAC Name: (3S)-2,3-dihydroxybutanedioic acid;ethyl (3S)-piperidine-3-carboxylate | CAS Registry Number: 83602-38-4
Synonyms: AKOS015950962, AB1007057, A840607, (3S)-2,3-bis(oxidanyl)butanedioic acid; ethyl (3S)-piperidine-3-carboxylate, (3S)-2,3-dihydroxybutanedioic acid; (3S)-3-piperidinecarboxylic acid ethyl ester

Molecular Formula:	C₁₂H₂₁NO₈	Molecular Weight:	307.297040 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	9

InChIKey: HHPGQKZOPPDLNH-JEVAITHQSA-N

• Ethylenediamine

IUPAC Name: ethane-1,2-diamine | CAS Registry Number: 107-15-3
Synonyms: ethylenediamine, 1,2-Ethanediamine, Ethylendiamine, Dimethylenediamine, Ethane-1,2-diamine, 1,2-Diaminoethane, Ethylene diamine, Mixture Name, beta-Aminoethylamine, Amerstat 274, Algicode 106L, 1,2-Ethylenediamine, Aethaldiamin [German], Caswell No. 437, Aminophylline Injection, Ethylenediamine [JAN], Ethyleendiamine [Dutch], Aethylenediamin [German], Ethylenediamine solution, Ethylene-diamine [French]

Molecular Formula:	C₂H₈N₂	Molecular Weight:	60.098320 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: PIICEJLVQHRZGT-UHFFFAOYSA-N

• EthyleneDiamineTetraacetic acid Tri-potassium Salt

IUPAC Name: tripotassium 2-[2-[bis(2-oxido-2-oxoethyl)amino]ethyl-(carboxymethyl)amino]acetate | CAS Registry Number: 17572-97-3
Synonyms: Tripotassium EDTA, Edetate tripotassium, Sequestrene 50K3, EDTA tripotassium salt, EDTA, tri K, 50% SOLN, EINECS 241-543-5, Tripotassium ethylenediaminetetraacetate, LS-72627, Tripotassium hydrogen ethylenediaminetetraacetate, Ethylenediaminetetraacetic acid, tripotassium salt, Acetic acid, (ethylenedinitrilo)tetra-, tripotassium salt, Glycine, N,N'-1,2-ethanediylbis(N-(carboxymethyl)-, tripotassium salt, N,N'-1,2-Ethanediylbis(N-(carboxymethyl)glycine), tripotassium salt, Acetic acid, (ethylenedinitrilo)tetra-, tripotassium salt (8CI)

Molecular Formula:	C₁₀H₁₃K₃N₂O₈	Molecular Weight:	406.513720 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	10

InChIKey: FYZXEMANQYHCFX-UHFFFAOYSA-K

• Ethylidene Diacetate

IUPAC Name: 1-acetyloxyethyl acetate | CAS Registry Number: 542-10-9
Synonyms: Ethylidene acetate, Delrin, Polyoxymethylenes, 1,1-Ethanediol, diacetate, 1,1-Diacetoxyethane, ETHYLIDENE DIACETATE, Ethylidene di(acetate), Benzenamine, hydrobromide, ethane-1,1-diyl diacetate, NSC8852, 1,1-Ethanediol, 1,1-diacetate, NSC 8852, EINECS 208-800-3, CID222536, ZINC01648271, AI3-24218, LS-191565, InChI=1/C6H10O4/c1-4(7)9-6(3)10-5(2)8/h6H,1-3H, 66455-31-0, 11098-35-4

Molecular Formula:	C₆H₁₀O₄	Molecular Weight:	146.141200 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: ACKALUBLCWJVNB-UHFFFAOYSA-N

• Flavokawain B

IUPAC Name: (E)-1-(2-hydroxy-4,6-dimethoxyphenyl)-3-phenylprop-2-en-1-one | CAS Registry Number: 1775-97-9
Synonyms: Flavokawain b, Spectrum5_000188, BSPBio_001873, SPECTRUM201610, MEGxp0_001270, NSC51351, ZINC04164657, CID5356121, CHALCONE,2-HYDROXY-4,6-DIMETHYL, NCGC00095512-01, NCGC00095512-02, ST5331409, 2-Propen-1-one, 1-(2-hydroxy-4,6-dimethoxyphenyl)-3-phenyl-, (E)-, 76554-24-0

Molecular Formula:	C₁₇H₁₆O₄	Molecular Weight:	284.306540 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: QKQLSQLKXBHUSO-CMDGGOBGSA-N

• GABOB (beta-hydroxy-GABA)

IUPAC Name: (3S)-4-amino-3-hydroxybutanoic acid | CAS Registry Number: 7013-05-0
Synonyms: (S)-4-AMINO-3-HYDROXYBUTANOIC ACID, (3S)-4-amino-3-hydroxybutanoic acid, SBB065945, (S)-(+)-Amino-3-hydroxybutanoic acid, (S)-(+)-4-Amino-3-hydroxybutyric acid, PubChem5723, AC1ODZKT, UNII-CM46XGM78M, CHEMBL296263, (S)-(+)-3-Hydroxy-GABA, CTK5D1896, CHEBI:162158, MolPort-003-983-914, DNC014732, AG-G-73773, (3S)-4-azanyl-3-oxidanyl-butanoic acid, AC-13943, AK126642, Butanoic acid,4-amino-3-hydroxy-, (3S)-, KB-211529

Molecular Formula:	C₄H₉NO₃	Molecular Weight:	119.119160 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: YQGDEPYYFWUPGO-VKHMYHEASA-N

• Glycidyl Nosylate

IUPAC Name: [(2R)-oxiran-2-yl]methyl 3-nitrobenzenesulfonate | CAS Registry Number: 115314-17-5
Synonyms: CCRIS 6393, 50047_FLUKA, (R)-Glycidyl 3-nitrobenzenesulfonate, BRN 4704458, ZINC01728514, (R)-(-)-Glycidyl 3-nitrobenzenesulfonate, Oxiranylmethyl (R)-3-nitrobenzenesulfonate, LS-32036, (R)-(−)-Glycidyl 3-nitrobenzenesulfonate, Benzenesulfonic acid, 3-nitro-, oxiranylmethyl ester, (R)-, (R)-(−)-Oxirane-2-methanol 3-nitrobenzenesulfonate

Molecular Formula:	C₉H₉NO₆S	Molecular Weight:	259.235860 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	6

InChIKey: AIHIHVZYAAMDPM-MRVPVSSYSA-N

• Grard's reagent T

IUPAC Name: (2-hydrazinyl-2-oxoethyl)-trimethylazanium chloride | CAS Registry Number: 123-46-6
Synonyms: Girard reagent T, Girard T reagent, Girard's reagent T, Girards Reagent T, Betaine hydrazide hydrochloride, G900_ALDRICH, Trimethylaminoacetohydrazide chloride, Carbazoylmethyltrimetylammonium chloride, NSC 9242, Trimethylacethydrazide ammonium chloride, Trimethylammonium chloride acethydrazide, .beta.ine hydrazide hydrochloride, Carbazoylmethyltrimethylammonium chloride, EINECS 204-629-3, NSC9242, AIDS018935, Trimethylammonium acetyl hydrazide chloride, AIDS-018935, (Carboxymethyl)trimethylammonium chloride hydrazide, Acethydrazide trimethylammonium chloride

Molecular Formula:	C₅H₁₄ClN₃O	Molecular Weight:	167.637160 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: YSULOORXQBDPCU-UHFFFAOYSA-N

• Hexafluoroacetylacetone

IUPAC Name: 1,1,1,5,5,5-hexafluoropentane-2,4-dione | CAS Registry Number: 1522-22-1
Synonyms: 238309_ALDRICH, 52503_FLUKA, TOS-BB-1109, EINECS 216-191-0, NSC174351, 1,1,1,5,5,5-Hexafluoroacetylacetone, 2,4-Pentanedione, 1,1,1,5,5,5-hexafluoro-, 1,1,1,5,5,5-Hexafluoropentane-2,4-dione, 1,1,1,5,5,5-Hexafluoro-2,4-pentanedione, 149182-28-5, 22466-49-5

Molecular Formula:	C₅H₂F₆O₂	Molecular Weight:	208.058599 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	8

InChIKey: QAMFBRUWYYMMGJ-UHFFFAOYSA-N

• Hexahydrophthalic Anhydride

IUPAC Name: 3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione | CAS Registry Number: 85-42-7
Synonyms: Lekutherm Hardener H, HHPA, Araldite HT 907, Hexahydrophthalic anhydride, 1,3-Isobenzofurandione, hexahydro-, Hexahydrophthalic acid anhydride, 1,2-Cyclohexanedicarboxylic anhydride, Hexahydro-2-benzofuran-1,3-dione, NT 907, NSC 8622, EINECS 201-604-9, NSC8622, Cyclohexane-1,2-dicarboxylic anhydride, 1,2-Cyclohexanedicarboxylic acid anhydride, EINECS 236-086-3, EINECS 238-009-9, cis-1,2-Cyclohexanedicarboxylic anhydride, cis-Cyclohexane-1,2-dicarboxylic anhydride, 1,3-Isobenzofurandione, hexahydro-, trans-, 1,3-Isobenzofurandione, hexahydro-, cis-

Molecular Formula:	C₈H₁₀O₃	Molecular Weight:	154.163200 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: MUTGBJKUEZFXGO-UHFFFAOYSA-N

• Ho-Epcp

IUPAC Name: (2R)-2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-(4-hydroxyphenyl)acetate | CAS Registry Number: 62893-24-7
Synonyms: ZINC02569283

Molecular Formula:	C₁₅H₁₆N₃O₆-	Molecular Weight:	334.304040 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: IPARGUVYMOMVNU-LLVKDONJSA-M

• Hyoscine n-butylbromide

Synonyms: Buscopan, Buscopan (TN), scopolamine butylbromide, Butylscopolamine bromide, Scopolamine butylbromide (JP15), D01451

Molecular Formula:	C₂₁H₃₀BrNO₄	Molecular Weight:	440.371200 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: HOZOZZFCZRXYEK-OXDSVUBJSA-M

• i-Inositol

IUPAC Name: cyclohexane-1,2,3,4,5,6-hexol | CAS Registry Number: 87-89-8
Synonyms: myo-inositol, inositol, meso-Inositol, Muco-Inositol, mesoinositol, Scyllo-inositol, Allo-inositol, epi-Inositol, Myoinositol, Dambose, chiro-inositol, Meat sugar, Iso-inositol, Phaseomannite, Phaseomannitol, Mesoinosite, Quercinitol, Inositene, Inositina, Mesoinosit

Molecular Formula:	C₆H₁₂O₆	Molecular Weight:	180.155880 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	6

InChIKey: CDAISMWEOUEBRE-UHFFFAOYSA-N

• β-Carotene

IUPAC Name: 1,3,3-trimethyl-2-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene | CAS Registry Number: 7235-40-7
Synonyms: beta-carotene, beta,beta-Carotene, Carotaben, Solatene, beta Carotene, Provitamin A, Provatene, Serlabo, Betacarotene, Vetoron, .beta. Carotene, Solatene (caps), trans-B-Carotene, Karotin [Czech], beta-Karotin, Food orange 5, b-Carotene, beta;-Carotene, .beta.-Carotene, Natural Yellow 26

Molecular Formula:	C₄₀H₅₆	Molecular Weight:	536.872640 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: OENHQHLEOONYIE-JLTXGRSLSA-N

• β-Caryophyllene

IUPAC Name: (1R,4E,9S)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene | CAS Registry Number: 87-44-5
Synonyms: Caryophyllene, BETA-CARYOPHYLLENE, Isocaryophyllene, L-Caryophyllene, beta-Caryophyllen, trans-Caryophyllene, Caryophyllene (VAN), .beta.-(E)-Caryophyllene, (-)-trans-Caryophyllene, beta-Caryophyllene (natural), C9653_SIGMA, W225207_ALDRICH, FEMA No. 2252, 22075_FLUKA, (−)-trans-Caryophyllene, EINECS 201-746-1, LMPR01030030, NSC 11906, SBB012403, NCGC00142620-01

Molecular Formula:	C₁₅H₂₄	Molecular Weight:	204.351060 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: NPNUFJAVOOONJE-GFUGXAQUSA-N

• Indium (III) Acetylacetonate

IUPAC Name: indium(3+); (Z)-4-oxopent-2-en-2-olate | CAS Registry Number: 14405-45-9
Synonyms: Nasemu Indium, Indium acetylacetonate, Tris(acetylacetonato)indium, Indium, tris(acetylacetonate), Indium, tris(acetylacetonato)-, Tris(2,4-pentanedionato)indium, Tris(acetylacetonato)indium(III), EINECS 238-378-6, NSC 166829, Tris(pentane-2,4-dionato-O,O')indium, INDIUM, TRIS(2,4-PENTANEDIONATO)-, LS-82065, Indium, tris(2,4-pentanedionato-kappaO,kappaO')-, (OC-6-11)-, Indium, tris(2,4-pentanedionato-O,O')-, (OC-6-11)-, Indium, tris(2,4-pentanedionato-O,O')-, (OC-6-11)- (9CI)

Molecular Formula:	C₁₅H₂₁InO₆	Molecular Weight:	412.141640 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	6

InChIKey: SKWCWFYBFZIXHE-LNTINUHCSA-K

• Isoborneol

IUPAC Name: (1R,4R,6R)-1,7,7-trimethylbicyclo[2.2.1]heptan-6-ol | CAS Registry Number: 124-76-5
Synonyms: (+/-)-Isoborneol, I13901_ALDRICH, W215805_ALDRICH, ZINC00968099, 507-70-0

Molecular Formula:	C₁₀H₁₈O	Molecular Weight:	154.249320 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: DTGKSKDOIYIVQL-MRTMQBJTSA-N

• L(-)-Mandelic Acid

IUPAC Name: (2S)-2-hydroxy-2-phenylacetic acid | CAS Registry Number: 17199-29-0
Synonyms: L-mandelic acid, (S)-Mandelic acid, (S)-Mandelate, D-Mandelic acid, (S)-Mandelsaeure, L-()-Mandelic acid, MANDELIC ACID, S(+)-Mandelic Acid, (S)-()-Mandelic acid, Hydroxy(phenyl)acetic acid, M2004_ALDRICH, (S)-2-Hydroxy-2-phenylacetate, (S)-mandelic acid, MLS000069517, L-(+)-MANDELIC ACID, (S)-2-Hydroxy-2-phenylacetic acid, 63462_FLUKA, CHEBI:32800, (2S)-hydroxy(phenyl)acetic acid, CPD-122

Molecular Formula:	C₈H₈O₃	Molecular Weight:	152.147320 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: IWYDHOAUDWTVEP-ZETCQYMHSA-N

• L-(+)-Dibenzoyl Tartraric Acid

IUPAC Name: (2R,3R)-2,3-bis(benzoyloxy)butanedioic acid | CAS Registry Number: 2743-38-6
Synonyms: Dibenzoyl-L-tartaric acid, Dibenzoyltartaric acid, Dibenzoyl d-tartaric acid, Tartaric acid, dibenzoate, (-)-Dibenzoyl tartaric acid, MLS001055407, 345849_ALDRICH, O,O-Dibenzoyl-(+)-tartaric acid, Tartaric acid, dibenzoate, (-)-, (-)-Dibenzoyl-L(+)-tartaric acid, 33620_FLUKA, DIBENZOIL-L-TARTARIC ACID, EINECS 220-374-0, L-Tartaric acid 2,3-dibenzoate, 2,3-Bis(benzoyloxy)tartaric acid, Dibenzoyl-L-tartaric acid monohydrate, NSC 118224, BRN 0709854, NCGC00091026-01, SMR001227193

Molecular Formula:	C₁₈H₁₄O₈	Molecular Weight:	358.298960 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	8

InChIKey: YONLFQNRGZXBBF-ZIAGYGMSSA-N

• L-Isoserine

IUPAC Name: (2S)-3-azaniumyl-2-hydroxypropanoate | CAS Registry Number: 632-13-3
Synonyms: ZINC02034711, ZINC02034713, CID6999796

Molecular Formula:	C₃H₇NO₃	Molecular Weight:	105.092580 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: BMYNFMYTOJXKLE-REOHCLBHSA-N

• L-Linalool

IUPAC Name: (3R)-3,7-dimethylocta-1,6-dien-3-ol | CAS Registry Number: 126-91-0
Synonyms: Linalool, Linalol, (-)-Linalool, (+)-Linalool, (3R)-Linalool, (3S)-Linalool, (R)-(-)-Linalool, Spectrum_000212, (S)-(+)-Linalool, SpecPlus_000909, Spectrum2_001944, Spectrum3_001173, Spectrum4_001777, Spectrum5_000393, CHEBI:28, (−)-Linalool, BSPBio_002785, KBioGR_002294, KBioSS_000692, 62139_ALDRICH

Molecular Formula:	C₁₀H₁₈O	Molecular Weight:	154.249320 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: CDOSHBSSFJOMGT-JTQLQIEISA-N

• L-Norvaline

IUPAC Name: (2S)-2-aminopentanoic acid | CAS Registry Number: 6600-40-4
Synonyms: norvaline, L-norvaline, Norvaline, L-, Norvaline (VAN), 2-Aminovaleric acid, L-2-Aminovaleric acid, L-2-aminopentanoic acid, 2-Aminopentanoic acid, (S)-2-Aminopentanoic acid, L-Norvaline (9CI), 2S-amino-pentanoic acid, Valeric acid, 2-amino-, (S)-2-Aminovaleric acid, Pentanoic acid, 2-amino-, alpha-L-Aminopentanoic acid, (2S)-2-aminopentanoic acid, N7627_SIGMA, 2-AMINO-PENTANOIC ACID, (S)-()-2-Aminopentanoic acid, CHEBI:18314

Molecular Formula:	C₅H₁₁NO₂	Molecular Weight:	117.146340 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: SNDPXSYFESPGGJ-BYPYZUCNSA-N

• L-Phenylalaninol

IUPAC Name: 2-amino-3-phenylpropan-1-ol | CAS Registry Number: 3182-95-4
Synonyms: S-Phenylalaninol, Phenylalaninol, (S)-2-Benzylethanolamine, (S)-beta-Aminobenzenepropanol, Benzenepropanol, beta-amino-, L-2-Amino-3-phenyl-1-propanol, L-2-Amino-3-phenylpropan-1-ol, 2-Amino-3-phenyl-1-propanol, (R)-2-Amino-3-phenylpropanol, EINECS 221-674-4, 1-Propanol, 2-amino-3-phenyl-, L-, NSC20899, EINECS 226-086-1, Benzenepropanol, beta-amino-, (S)-, NSC 20899, NSC133421, Benzenepropanol, .beta.-amino-, (R)-, NCGC00095352-01, (S)-(-)-2-Amino-3-phenyl-1-propanol, LS-121681

Molecular Formula:	C₉H₁₃NO	Molecular Weight:	151.205620 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: STVVMTBJNDTZBF-UHFFFAOYSA-N

• L-Pipecolic acid

IUPAC Name: piperidine-2-carboxylic acid | CAS Registry Number: 3105-95-1
Synonyms: Pipecolic acid, Homoproline, Pipecolinic acid, pipecolate, Dihydrobaikiane, l-Pipecolic acid, L-pipecolate, Piperolinic acid, homopipecolic acid, Hexahydropicolinic acid, Pipecolic acid, L-, L-Pipecolinic acid, 2-PIPERIDINECARBOXYLIC ACID, DL-Pipecolinic acid, .alpha.-Pipecolinic acid, Acide pipecolique [French], Pipecolic acid free base, Pipecolic acid, L-(-)-, Pipecolic acid, (S)-(-)-, pipecolic acid, ion (1-)

Molecular Formula:	C₆H₁₁NO₂	Molecular Weight:	129.157040 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: HXEACLLIILLPRG-UHFFFAOYSA-N

• L-Prolinamide

IUPAC Name: (2S)-pyrrolidine-2-carboxamide | CAS Registry Number: 7531-52-4
Synonyms: Prolinamide, L-prolinamide, (S)-Prolinamide, (S)-Pyrrolidine-2-carboxamide, 287059_ALDRICH, 81722_FLUKA, EINECS 231-397-0, SBB006531, NCGC00159402-02, TL8005159, DPR

Molecular Formula:	C₅H₁₀N₂O	Molecular Weight:	114.145700 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: VLJNHYLEOZPXFW-BYPYZUCNSA-N

• Ledene

IUPAC Name: 1,1,4,7-tetramethyl-1a,2,3,5,6,7,7a,7b-octahydrocyclopropa[e]azulene | CAS Registry Number: 21747-46-6
Synonyms: (+)-Ledene, EINECS 244-565-3, (1AR-(1aalpha,7alpha,7abeta,7balpha))-1a,2,3,5,6,7,7a,7b-octahydro-1,1,4,7-tetramethyl-1H-cycloprop(e)azulene, 1H-Cycloprop[e]azulene, 1a,2,3,5,6,7,7a,7b-octahydro-1,1,4,7-tetramethyl-, [1aR-(1a.alpha.,7.alpha.,7a.beta.,7b.alpha.)]-

Molecular Formula:	C₁₅H₂₄	Molecular Weight:	204.351060 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: WGTRJVCFDUCKCM-UHFFFAOYSA-N

• Levalbuterol

IUPAC Name: 4-[(1R)-2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol | CAS Registry Number: 34391-04-3
Synonyms: Levosalbutamol, R-Salbutamol, R-Albuterol, (-)-Salbutamol, (-)-Albuterol, (R)-salbutamol, (R)-albuterol, nchembio790-comp3, Tocris-0634, Lopac-S-5013, Lopac-S-8260, CHEBI:8746, NCGC00015955-01, NCGC00015955-02, NCGC00016736-01, NCGC00024698-01, LS-29860, CAS-18559-94-9, LS-187796, C11770

Molecular Formula:	C₁₃H₂₁NO₃	Molecular Weight:	239.310740 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	4

InChIKey: NDAUXUAQIAJITI-LBPRGKRZSA-N

• Linalool

IUPAC Name: 3,7-dimethylocta-1,6-dien-3-ol | CAS Registry Number: 78-70-6
Synonyms: beta-Linalool, allo-Ocimenol, p-Linalool, Linalol, .beta.-Linalool, ( )-linalool, LINALYL ALCOHOL, L-Linalool, Linalool (natural), (S)-Linalol, (+-)-Linalool, Caswell No. 526A, 3,7-Dimethylocta-1,6-dien-3-ol, FEMA Number 2635, LINOLOOL (D), 1,6-Octadien-3-ol, 3,7-dimethyl-, 2,6-Dimethylocta-2,7-dien-6-ol, 3,7-Dimethyl-1,6-octadien-3-ol, FEMA No. 2635, CCRIS 3726

Molecular Formula:	C₁₀H₁₈O	Molecular Weight:	154.249320 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: CDOSHBSSFJOMGT-UHFFFAOYSA-N

• m-Chloro Propiophenone

IUPAC Name: 1-(3-chlorophenyl)propan-1-one | CAS Registry Number: 34841-35-5
Synonyms: 3'-Chloropropiophenone, m-Chloropropiophenone, 248193_ALDRICH, EINECS 252-242-3, 1-Propanone, 1-(3-chlorophenyl)-, ZINC00407109, ST5405393, TL8002590

Molecular Formula:	C₉H₉ClO	Molecular Weight:	168.620160 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: PQWGFUFROKIJBO-UHFFFAOYSA-N

• Maleic hydrazide

IUPAC Name: 1,2-dihydropyridazine-3,6-dione | CAS Registry Number: 123-33-1
Synonyms: Vondalhyde, Antergon, Antyrost, Malazide, Stuntman, Regulox, Vondrax, Malzid, Retard, MALEIC HYDRAZIDE, Sprout/off, Maleic hydrazine, De-sprout, Sucker-Stuff, Super-de-sprout, Sprout-Stop, Burtolin, Chemform, Unriprim, Milurit

Molecular Formula:	C₄H₄N₂O₂	Molecular Weight:	112.086760 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: BGRDGMRNKXEXQD-UHFFFAOYSA-N

• Matricaria (Chamomile)

IUPAC Name: 1,7,7-trimethylbicyclo[2.2.1]heptan-2-one | CAS Registry Number: 21368-68-3
Synonyms: camphor, 2-Camphanone, Formosa camphor, Laurel camphor, 2-Bornanone, DL-Camphor, Gum camphor, Alcanfor, Alphanon, Root bark oil, Sarna, Heet, Spirit of camphor, Japanese camphor, (+)-Camphor, Kampfer, Camphor USP, d-2-Camphanone, Matricaria camphor, Japan camphor

Molecular Formula:	C₁₀H₁₆O	Molecular Weight:	152.233440 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: DSSYKIVIOFKYAU-UHFFFAOYSA-N

• Mebrofenin

IUPAC Name: 2-[[2-(3-bromo-2,4,6-trimethylanilino)-2-oxoethyl]-(carboxymethyl)amino]acetic acid | CAS Registry Number: 78266-06-5
Synonyms: Choletec, MEBROFENIN, Mebrofenine, Mebrofenino, Mebrofeninum, Mebrofenine [INN-French], Mebrofeninum [INN-Latin], Mebrofenino [INN-Spanish], Mebrofenin (USAN/INN), Mebrofenin [USAN:INN], UNII-7PV0B6ED98, EINECS 278-877-6, CID54158, SQ 26962, NCGC00181297-01, LS-72341, SQ-26962, D04869, ((((3-Bromomesityl)carbamoyl)methyl)imino)diacetic acid, Glycine, N-(2-((3-bromo-2,4,6-trimethylphenyl)amino)-2-oxoethyl)-N-(carboxymethyl)-

Molecular Formula:	C₁₅H₁₉BrN₂O₅	Molecular Weight:	387.225760 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: MHPZZZZLAQGTHT-UHFFFAOYSA-N

• Menthol: Synthetic, Racemic

IUPAC Name: 5-methyl-2-propan-2-ylcyclohexan-1-ol | CAS Registry Number: 15356-70-4
Synonyms: dl-Menthol, MENTHOL, Hexahydrothymol, Dermoplast, Racementhol, Sarna, Menthyl alcohol, d-Neomenthol, Menthacamphor, Menthomenthol, Neoisomenthol, d,l-Menthol, Menthol natural, Menthol racemic, Racemic menthol, rac-Menthol, Menthol solution, Menthol, dl-, Mixture Name, d-Menthol

Molecular Formula:	C₁₀H₂₀O	Molecular Weight:	156.265200 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: NOOLISFMXDJSKH-UHFFFAOYSA-N

• Menthyl acetate

IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] acetate | CAS Registry Number: 2623-23-6
Synonyms: L-Menthyl acetate, (-)-Menthyl acetate, (dl)-Menthyl acetate, Menthyl acetate, dl-, (+-)-Menthol acetate, (+-)-Menthyl acetate, L-p-Menth-3-yl acetate, p-Menth-3-yl acetate, dl-, (1R)-(-)-Menthyl acetate, W266825_ALDRICH, NSC3722, 441058_ALDRICH, NSC52970, 45985_FLUKA, 45990_FLUKA, CPD-5761, EINECS 201-911-8, EINECS 249-409-8, CID220674, ZINC01850068

Molecular Formula:	C₁₂H₂₂O₂	Molecular Weight:	198.301880 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: XHXUANMFYXWVNG-ADEWGFFLSA-N

• Menthyl lactate

IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2-hydroxypropanoate | CAS Registry Number: 59259-38-0
Synonyms: Frescolat, l-Menthyl lactate, MENTHYL LACTATE, Menthyl lactate, L-, FEMA No. 3748, Menthan-3-yl lactate, (-)-p-, STOCK1N-07137, EINECS 261-678-3, LS-179826, 5-Methyl-2-(1-methylethyl)cyclohexyl alpha-hydroxypropanoate, 2-Hydroxypropanoic acid, 5-methyl-2-(1-methylethyl)cyclohexyl ester, (1R-(1alpha(R*),2beta,5alpha))-5-Methyl-2-(1-methylethyl)cyclohexyl lactate, Propanoic acid, 2-hydroxy-, 5-methyl-2-(1-methylethyl)cyclohexyl ester, 5-Methyl-2-(1-methylethyl)cyclohexyl 2-hydroxypropanoate, (1R-(1alpha(R*),2beta,5alpha))-, Propanoic acid, 2-hydroxy-, 5-methyl-2-(1-methylethyl)cyclohexyl ester, (1R-(1alpha(R*),2beta,5alpha))-, Propanoic acid, 2-hydroxy-, 5-methyl-2-(1-methylethyl)cyclohexyl ester, (1theta-(1alpha(theta),2beta,5alpha))-

Molecular Formula:	C₁₃H₂₄O₃	Molecular Weight:	228.327860 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: UJNOLBSYLSYIBM-SGUBAKSOSA-N

• Methyl (2R)-Glycidate

IUPAC Name: methyl (2R)-oxirane-2-carboxylate | CAS Registry Number: 111058-32-3
Synonyms: (R)-methyl oxirane-2-carboxylate, (R)-Methyglycidate, Methyl (2R)-glycidate, Methyl (R)-oxiranecarboxylate, 469424_ALDRICH, CTK8B8192, MolPort-003-933-967, ANW-59619, AKOS015899909, AK-45076, KB-210410, FT-0645738, I14-11571

Molecular Formula:	C₄H₆O₃	Molecular Weight:	102.088640 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: YKNYRRVISWJDSR-GSVOUGTGSA-N

• N,N,N',N',N''-Pentamethyl-diethylenetriamine (PM-DETA)

IUPAC Name: N-(2-dimethylaminoethyl)-N,N',N'-trimethylethane-1,2-diamine | CAS Registry Number: 3030-47-5
Synonyms: pmdien, PMDT, Pentamethyldiethylenetriamine, PMDTA, Pentamethyldiethylenetriaminek, N,N',N''-Pentamethyldiethylenetriamine, 369497_ALDRICH, 1,1,4,7,7-Pentamethyldiethylenetriamine, Bis(2-dimethylaminoethyl)(methyl)amine, 2,5,8-Trimethyl-2,5,8-triazanonane, 76828_FLUKA, CHEBI:39475, EINECS 221-201-1, NSC 65659, Diethylenetriamine, 1,1,4,7,7-pentamethyl-, N,N,N',N',N''-Pentamethyldiethylenetriamine, NSC65659, BRN 1741396, N,N,N',N'',N''-Pentamethyldiethylenetriamine, WLN: 1N1&2N1&2N1&1

Molecular Formula:	C₉H₂₃N₃	Molecular Weight:	173.299020 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: UKODFQOELJFMII-UHFFFAOYSA-N

• N,N,N',N'-Tetramethyl Guanidine

IUPAC Name: 1,1,3,3-tetramethylguanidine | CAS Registry Number: 80-70-6
Synonyms: 1,1,3,3-Tetramethylguanidine, N,N,N',N'-Tetramethylguanidine, Guanidine, N,N,N',N'-tetramethyl-, Guanidine, 1,1,3,3-tetramethyl-, 241768_ALDRICH, CCRIS 6689, EINECS 201-302-7, NSC148309, NSC 148309, AI3-51030, Guanidine, 1,1,3,3-tetramethyl- (8CI), InChI=1/C5H13N3/c1-7(2)5(6)8(3)4/h6H,1-4H, 142118-43-2, 1729-17-5, 197451-33-5

Molecular Formula:	C₅H₁₃N₃	Molecular Weight:	115.176820 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: KYVBNYUBXIEUFW-UHFFFAOYSA-N

• N,N-Diethyl-1,1,2,3,3,3-Hexafluoropropylamine

IUPAC Name: N,N-diethyl-1,1,2,3,3,3-hexafluoropropan-1-amine | CAS Registry Number: 309-88-6
Synonyms: Ishikawa's Reagent, 564990_ALDRICH, CID136149, N,N-Diethyl 1,1,2,3,3,3-hexafluoropropylamine, LT03496539, N,N-Diethyl-1,1,2,3,3,3-hexafluoropropylamine, 3S102995, 3S210816

Molecular Formula:	C₇H₁₁F₆N	Molecular Weight:	223.159359 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	7

InChIKey: BNTFCVMJHBNJAR-UHFFFAOYSA-N

• N-Cbz-D-Pro-OH

IUPAC Name: (2R)-1-(phenylmethoxycarbonyl)pyrrolidine-2-carboxylic acid | CAS Registry Number: 6404-31-5
Synonyms: ()-Z-D-proline, 860735_ALDRICH, EINECS 229-021-5, SB 02004, 1-Benzyl hydrogen (R)-pyrrolidine-1,2-dicarboxylate

Molecular Formula:	C₁₃H₁₅NO₄	Molecular Weight:	249.262500 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: JXGVXCZADZNAMJ-LLVKDONJSA-N

• N-Methyldiphenylamine

IUPAC Name: N-methyl-N-phenylaniline | CAS Registry Number: 552-82-9
Synonyms: Demelverine, Diphenylmethylamine, N-Methyl-N-phenylaniline, Diphenylamine, N-methyl-, N,N-Diphenylmethylamine, METHYLDIPHENYLAMINE, Benzenamine, N-methyl-N-phenyl-, N-Methyldiphenethylamine, 524212_ALDRICH, N,N-DIPHENYL METHYLAMINE, NSC3790, Diphenylamine, N-methyl- (8CI), NSC 3790, EINECS 209-023-2, AI3-02479, ST5405725, TL8003608, InChI=1/C13H13N/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H, 171745-65-6

Molecular Formula:	C₁₃H₁₃N	Molecular Weight:	183.249020 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: DYFFAVRFJWYYQO-UHFFFAOYSA-N

• N-Phenylmaleimide

IUPAC Name: 1-phenylpyrrole-2,5-dione | CAS Registry Number: 941-69-5
Synonyms: Maleinanil, Maleanil, Maleimidobenzene, MALEIMIDE, N-PHENYL-, WLN: T5VNVJ BR, ChemDiv3_000283, 1H-Pyrrole-2,5-dione, 1-phenyl-, P27100_ALDRICH, NSC 8183, 78795_FLUKA, EINECS 213-382-0, NSC8183, 1-Phenyl-1H-pyrrole-2,5-dione, N-Fenylimid kyseliny maleinove [Czech], BRN 0125098, SBB007849, ZINC00114118, AI3-01186, FR-0453, IDI1_019601

Molecular Formula:	C₁₀H₇NO₂	Molecular Weight:	173.168080 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: HIDBROSJWZYGSZ-UHFFFAOYSA-N

• N12N

IUPAC Name: dodecane-1,12-diamine | CAS Registry Number: 2783-17-7
Synonyms: Dodecyldiamine, 1,12-Diaminododecane, Dodecamethylenediamine, 1,12-Diamindodecane, 1,12-DODECANEDIAMINE, 1,12-Dodecamethylenediamine, 1,12'-Dodecylenediamine, 1,12-Dodecylenediamine, 1,12'-Dodecamethylenediamine, D16401_ALDRICH, EINECS 220-489-6, NSC 55050, NSC 59861, NSC55050, NSC59861, BRN 1742765, LS-63440, 4-04-00-01376 (Beilstein Handbook Reference), 15536-18-2, 95931-03-6

Molecular Formula:	C₁₂H₂₈N₂	Molecular Weight:	200.364120 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: QFTYSVGGYOXFRQ-UHFFFAOYSA-N

• Naringenin

IUPAC Name: 4-tert-butylphenol;formaldehyde | CAS Registry Number: 93602-28-9
Synonyms: Ckm 1634, 4-tert-butylphenol; formaldehyde, AG-G-60074, p-tert-Butylphenol, formaldehyde resin, Formaldehyde, p-tert-butylphenol polymer, formaldehyde- 4-tert-butylphenol(1:1), FORMALDEHYDE; 4-TERT-BUTYLPHENOL, 4-(1,1-Dimethylethyl)phenol, formaldehyde polymer, 68130-76-7, 4-(1,1-Dimethylethyl)phenol, polymer with formaldehyde, Formaldehyde, polymer with 4-(1,1-dimethylethyl)phenol, Paraformaldehyde, formaldehyde, p-tert-butylphenol polymer, 106441-81-0, AC1L2XPK, SureCN332381, 4-tert-butylphenol; methanal, CTK5C7358, AC1Q6915, 26808-99-1 (magnesium salt), AR-1J0888

Molecular Formula:	C₁₁H₁₆O₂	Molecular Weight:	180.243540 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: LZDOYVMSNJBLIM-UHFFFAOYSA-N

• nerolidol

IUPAC Name: (6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-ol | CAS Registry Number: 7212-44-4
Synonyms: NEROLIDOL, Stirrup, trans-Nerolidol, Peruviol, .beta.-Nerolidol, d-Nerolidol, .alpha.-Nerolidol, E-Nerolidol, Nerolidol 1, Nerolidol 2, Nerolidol (natural), Nerolidol (E), Nerolidol (VAN), (+)-Nerolidol, Nerolidol (6CI), Nerolidol trans-form, .+/-.-trans-Nerolidol, Spectrum5_000460, FCI 119b, Methylvinylhomogeranyl carbinol

Molecular Formula:	C₁₅H₂₆O	Molecular Weight:	222.366340 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: FQTLCLSUCSAZDY-SDNWHVSQSA-N