C/D/N Isotopes Inc.

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Profile: C/D/N Isotopes Inc. manufactures deuterium labelled compounds. Our products are alkanes, amino acids, fatty acids, hydrocarbon gases, pesticides & pesticide metabolites and steroids.

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• Ac-Ala-OH

IUPAC Name: 2-acetamidopropanoic acid | CAS Registry Number: 97-69-8
Synonyms: Acetylalanine, N-ACETYLALANINE, N-Acetyl-S-alanine, L-Alanine, N-acetyl-, N-Acetyl-L-alanine, N-Acetyl-DL-alanine, Alanine, N-acetyl-, L-, DL-Alanine, N-acetyl-, 2-acetamidopropanoic acid, 2-Acetamidopropionic acid, 2-Acetylaminopropionic acid, L-Alanine, N-acetyl- (9CI), Alanine, N-acetyl-, L- (8CI), NSC43118, EINECS 202-602-0, EINECS 214-229-0, NSC186892, NSC203819, SBB000064, DB02518

Molecular Formula:	C₅H₉NO₃	Molecular Weight:	131.129860 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: KTHDTJVBEPMMGL-UHFFFAOYSA-N

• Acetal

IUPAC Name: 1,1-diethoxyethane | CAS Registry Number: 105-57-7
Synonyms: Diethyl acetal, Diethylacetal, Acetol, polyacetal, Diaethylacetal, Acetaal, Acetaal [Dutch], Ethane, 1,1-diethoxy-, 1,1-DIETHOXYETHANE, Acetal (natural), Acetale [Italian], Acetal diethylique, Ethane, diethoxy-, Ethylidene diethyl ether, Acetaldehyde, diethyl acetal, Acetaldehyde diethyl acetal, Ethylidenediethyl ether, 1,1-Dietossietano, Diaethylacetal [German], Acetaldehyde ethyl acetal

Molecular Formula:	C₆H₁₄O₂	Molecular Weight:	118.174160 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: DHKHKXVYLBGOIT-UHFFFAOYSA-N

• Acetaldehyde

IUPAC Name: acetaldehyde | CAS Registry Number: 75-07-0
Synonyms: acetaldehyde, ethanal, acetic aldehyde, ethyl aldehyde, Acetylaldehyde, aldehyde, Acetic ethanol, Acetaldehyd, acetaldehydes, ethaldehyde, Ethylaldehyde, Acetaldeyde, Aceteldehyde, Azetaldehyd, Aldeide acetica, Octowy aldehyd, Aldehyde acetique, Acetaldehyde (natural), Acetaldehyd [German], Acetaldehyde solution

Molecular Formula:	C₂H₄O	Molecular Weight:	44.052560 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: IKHGUXGNUITLKF-UHFFFAOYSA-N

• Acetaldehyde 2,4-dinitrophenylhydrazone

IUPAC Name: N-(ethylideneamino)-2,4-dinitroaniline | CAS Registry Number: 1019-57-4
Synonyms: Acetaldehyde-2,4-DNPH, BCR547_FLUKA, 442434_SUPELCO, NSC 403216, 429554_SIAL, Acetaldehyde, 2,4-dinitrophenylhydrazone, Acetaldehyde (2,4-dinitrophenyl)hydrazone, Acetaldehyde-2,4-dinitrophenylhydrazone, LS-7913, (1E)-ethanal (2,4-dinitrophenyl)hydrazone

Molecular Formula:	C₈H₈N₄O₄	Molecular Weight:	224.173520 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: ONBOQRNOMHHDFB-XNWCZRBMSA-N

• Acetaldehyde Dimethyl Acetal

IUPAC Name: 1,1-dimethoxyethane | CAS Registry Number: 534-15-6
Synonyms: Dimethyl acetal, Dimethylacetal, Methyl formyl, Dimethoxyethane, Dimethyl aldehyde, Ethane, 1,1-dimethoxy-, 1,1-DIMETHOXYETHANE, Ethane, dimethoxy-, Acetaldehyde dimethyl acetal, Acetaldehyde, dimethyl acetal, Ethylidene dimethyl ether, Acetaldehyde methyl acetal, 3-Methyl-2,4-dioxapentane, FEMA No. 3426, HSDB 5427, W342602_ALDRICH, 385395_ALDRICH, 00120_FLUKA, EINECS 208-589-8, UN2377

Molecular Formula:	C₄H₁₀O₂	Molecular Weight:	90.121000 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: SPEUIVXLLWOEMJ-UHFFFAOYSA-N

• Acetamide

IUPAC Name: acetamide | CAS Registry Number: 60-35-5
Synonyms: acetamide, Ethanamide, Acetic acid amide, Acetimidic acid, Methanecarboxamide, Ethanimidic acid, acetamid, Essigsaeureamid, Azetamid, Ethanamid, Amide C2, Caswell No. 003H, CCRIS 2, Acetimidic acid (VAN), CH3CONH2, Lopac-A-0500, acetamide, monosodium salt, Amid kyseliny octove [Czech], HSDB 4006, WLN: ZV1

Molecular Formula:	C₂H₅NO	Molecular Weight:	59.067200 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: DLFVBJFMPXGRIB-UHFFFAOYSA-N

• Acetaminophen

IUPAC Name: N-(4-hydroxyphenyl)acetamide | CAS Registry Number: 103-90-2
Synonyms: acetaminophen, Paracetamol, Tylenol, Datril, Acetaminofen, Algotropyl, Naprinol, 4-Acetamidophenol, Lonarid, Panadol, Acamol, Anelix, Multin, APAP, p-Acetamidophenol, p-Acetaminophenol, Paracetamolo, Abensanil, Acetagesic, Acetalgin

Molecular Formula:	C₈H₉NO₂	Molecular Weight:	151.162560 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: RZVAJINKPMORJF-UHFFFAOYSA-N

• Acetanilide

IUPAC Name: N-phenylacetamide | CAS Registry Number: 103-84-4
Synonyms: acetanilide, N-Phenylacetamide, Antifebrin, Acetylaniline, Acetanilid, Acetanil, Acetamidobenzene, N-Acetylaniline, Acetoanilide, Phenalgene, Phenalgin, Acetylaminobenzene, Acetic acid anilide, Ethananilide, Acetamide, N-phenyl-, 2-Acetanilide, N-acetylarylamine, Aniline, N-acetyl-, Benzenamine, N-acetyl-, N-Acetylaminobenzene

Molecular Formula:	C₈H₉NO	Molecular Weight:	135.163160 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: FZERHIULMFGESH-UHFFFAOYSA-N

• Acetic Acid

IUPAC Name: acetic acid | CAS Registry Number: 64-19-7
Synonyms: acetic acid, ethanoic acid, Acetasol, Glacial acetic acid, Ethylic acid, Vinegar acid, Essigsaeure, Acetic acid, glacial, Otic Tridesilon, Otic Domeboro, acetate, Aci-jel, Azijnzuur, Pyroligneous acid, Vinegar, ethoic acid, Acide acetique, Barium acetate, Sodium acetate, Acido acetico

Molecular Formula:	C₂H₄O₂	Molecular Weight:	60.051960 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: QTBSBXVTEAMEQO-UHFFFAOYSA-N

• Acetic-D3 Acid-D

IUPAC Name: deuterio 2,2,2-trideuterioacetate | CAS Registry Number: 1186-52-3
Synonyms: Acetic-d3 acid-d, Acetic acid-d4, Tetradeuteroacetic acid, (2H3)Acetic (2H)acid, 151785_ALDRICH, 233315_ALDRICH, 237000_ALDRICH, 269743_ALDRICH, 416886_ALDRICH, 530484_ALDRICH, 613061_ALDRICH, EINECS 214-693-4, CID2723903, Acetic acid, glacial or acetic acid solution, >80% acid, by mass [UN2789] [Corrosive]

Molecular Formula:	C₂H₄O₂	Molecular Weight:	64.076607 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: QTBSBXVTEAMEQO-GUEYOVJQSA-N

• Acetochlor

IUPAC Name: 2-chloro-N-(ethoxymethyl)-N-(2-ethyl-6-methylphenyl)acetamide | CAS Registry Number: 34256-82-1
Synonyms: acetochlor, Azetochlor, Harness, Nevirex, Acenit, Erunit, Acetochlore, Caswell No. 003B, Spectrum_001979, Acetochlore [ISO-French], SpecPlus_000626, Spectrum2_001915, Spectrum3_000873, Spectrum4_000713, Spectrum5_002071, Acetochlor [ANSI:BSI:ISO], PS2040_SUPELCO, CCRIS 7709, BSPBio_002545, KBioGR_001265

Molecular Formula:	C₁₄H₂₀ClNO₂	Molecular Weight:	269.767100 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: VTNQPKFIQCLBDU-UHFFFAOYSA-N

• Acetone

IUPAC Name: propan-2-one | CAS Registry Number: 67-64-1
Synonyms: acetone, 2-propanone, propanone, Dimethyl ketone, Methyl ketone, Dimethylketal, Pyroacetic ether, Chevron acetone, Pyroacetic acid, Ketone propane, beta-Ketopropane, Aceton, Dimethylformaldehyde, Ketone, dimethyl, dimethylcetone, dimethylketone, Dimethylketon, Propanon, Azeton, Acetone (natural)

Molecular Formula:	C₃H₆O	Molecular Weight:	58.079140 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: CSCPPACGZOOCGX-UHFFFAOYSA-N

• Acetone-D6

IUPAC Name: propan-2-one | CAS Registry Number: 666-52-4
Synonyms: acetone, 2-propanone, propanone, Dimethyl ketone, Methyl ketone, Dimethylketal, Chevron acetone, Pyroacetic ether, Pyroacetic acid, Ketone propane, beta-Ketopropane, Aceton, Dimethylformaldehyde, Ketone, dimethyl, dimethylcetone, dimethylketone, Dimethylketon, Propanon, Azeton, Acetone (natural)

Molecular Formula:	C₃H₆O	Molecular Weight:	58.079140 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: CSCPPACGZOOCGX-UHFFFAOYSA-N

• Acetonitrile

IUPAC Name: acetonitrile | CAS Registry Number: 75-05-8
Synonyms: Cyanomethane, ACETONITRILE, Methyl cyanide, Ethanenitrile, Ethyl nitrile, Methane, cyano-, Methanecarbonitrile, Ethanonitrile, Acetonitril, Ethane nitrile, Cyanure de methyl, MeCN, NCMe, Methylkyanid [Czech], CC.equiv.N, Acetonitrile solution, Methylidyne, cyano-, RCRA waste no. U003, RCRA waste number U003, USAF EK-488

Molecular Formula:	C₂H₃N	Molecular Weight:	41.051920 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: WEVYAHXRMPXWCK-UHFFFAOYSA-N

• Acetonitrile-D3

IUPAC Name: 2,2,2-trideuterioacetonitrile | CAS Registry Number: 2206-26-0
Synonyms: Cyanomethane, Acetonitrile-d3, Acetonitrile-d3-, Methyl-d3 cyanide, (2H3)Acetonitrile, Trideuteroacetonitrile, CD3CN, 151807_ALDRICH, 233323_ALDRICH, 233331_ALDRICH, 236861_ALDRICH, 237019_ALDRICH, 308714_ALDRICH, 366544_ALDRICH, 423106_ALDRICH, 425796_ALDRICH, 441317_ALDRICH, 444723_ALDRICH, 522147_ALDRICH, 530883_ALDRICH

Molecular Formula:	C₂H₃N	Molecular Weight:	44.070405 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: WEVYAHXRMPXWCK-FIBGUPNXSA-N

• Acetonyl Acetone

IUPAC Name: hexane-2,5-dione | CAS Registry Number: 110-13-4
Synonyms: Acetonylacetone, 2,5-HEXANEDIONE, Acetonyl acetone, Diacetonyl, 2,5-Diketohexane, Acetone, acetonyl-, 2,5-Hexadione, acetone, acetonyl, 1,2-Diacetylethane, Hexane-2,5-dione, 2,5-Hexandione, ACAN, alpha,beta-Diacetylethane, .alpha.,.beta.-Diacetylethane, CCRIS 2919, MLS001065580, 165131_ALDRICH, WLN: 1V2V1, NSC 7621, 00770_FLUKA

Molecular Formula:	C₆H₁₀O₂	Molecular Weight:	114.142400 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: OJVAMHKKJGICOG-UHFFFAOYSA-N

• Acetophenone

IUPAC Name: 1-phenylethanone | CAS Registry Number: 98-86-2
Synonyms: ACETOPHENONE, 1-Phenylethanone, Acetylbenzene, Methyl phenyl ketone, Acetophenon, Hypnone, Benzoyl methide, Phenyl methyl ketone, Ethanone, 1-phenyl-, Acetylbenzol, Benzoylmethide, Hypnon, Phenyl, Benzene, acetyl-, methylphenylketone, phenylmethylketone, 1-Phenyl-1-ethanone, Acetofenon [Czech], Ketone, methyl phenyl, 1-phenylethan-1-one

Molecular Formula:	C₈H₈O	Molecular Weight:	120.148520 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: KWOLFJPFCHCOCG-UHFFFAOYSA-N

• Acetyl-L-carnitine hydrochloride

IUPAC Name: 3-acetyloxy-4-(trimethylazaniumyl)butanoate hydrochloride | CAS Registry Number: 5080-50-2
Synonyms: o-Acetyl-L-carnitine hydrochloride, Acetylcarnitine L-form hydrochloride, 1-Propanaminium, 2-(acetyloxy)-3-carboxy-N,N,N-trimethyl-, chloride, (R)-

Molecular Formula:	C₉H₁₈ClNO₄	Molecular Weight:	239.696520 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: JATPLOXBFFRHDN-UHFFFAOYSA-N

• Acetylchloride

IUPAC Name: acetyl chloride | CAS Registry Number: 75-36-5
Synonyms: Ethanoyl chloride, ACETYL CHLORIDE, Acetic chloride, Acetic acid, chloride, Acetic acid chloride, CH3COCl, RCRA waste no. U006, RCRA waste number U006, CH3-CO-Cl, ACETIC ACID,CHLORIDE, CCRIS 4568, HSDB 662, 320129_ALDRICH, 00990_FLUKA, CHEBI:37580, EINECS 200-865-6, UN1717, 114189_SIAL, 239577_SIAL, BRN 0605303

Molecular Formula:	C₂H₃ClO	Molecular Weight:	78.497620 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: WETWJCDKMRHUPV-UHFFFAOYSA-N

• Acetylcholine bromide

IUPAC Name: 2-acetyloxyethyl(trimethyl)azanium bromide | CAS Registry Number: 66-23-9
Synonyms: Pragmoline, Tonocholin B, Bromoacetylcholine, Acetylcholine bromhydrate, Acetylcholine hydrobromide, Choline, acetyl-, bromide, Choline acetate (ester), bromide, MLS000069523, MLS001148385, A6500_SIGMA, NSC 4678, 01010_FLUKA, EINECS 200-622-4, NSC4678, Acetoxyethyl-trimethylammonium bromide, Trimethyl(2-acetoxyethyl)ammonium bromide, (2-Acetoxyethyl)trimethylammonium bromide, AI3-10598, N,N,N-Trimethyl-2-acetoxyethylammonium bromide, LS-53169

Molecular Formula:	C₇H₁₆BrNO₂	Molecular Weight:	226.111440 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: ZEHGKSPCAMLJDC-UHFFFAOYSA-M

• Acetylcholine chloride

IUPAC Name: 2-acetyloxyethyl(trimethyl)azanium chloride | CAS Registry Number: 60-31-1
Synonyms: Miochol, Arterocoline, Acecholin, Acecoline, Ovisot, Chloroacetylcholine, acetylcholine, ACH chloride, Azetylcholinchlorid, ACETYLCHOLINE CHLORIDE, Miochol (TN), Acetylcholinium chloride, O-Acetylcholine chloride, Choline, chloride acetate, MIOCHOL-E, Acetylcholine hydrochloride, Acetilcolina cloruro [DCIT], C7H16NO2.Cl, Choline acetate (ester) chloride, MLS000028640

Molecular Formula:	C₇H₁₆ClNO₂	Molecular Weight:	181.660440 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: JUGOREOARAHOCO-UHFFFAOYSA-M

• Aspirin

IUPAC Name: 2-acetyloxybenzoic acid | CAS Registry Number: 50-78-2
Synonyms: aspirin, Acylpyrin, Colfarit, Ecotrin, Acetylsalicylate, Enterosarein, Acenterine, Polopiryna, Micristin, Acetosal, Easprin, ACETYLSALICYLIC ACID, Acetosalic acid, Enterosarine, Acetophen, Acetosalin, Acetylsal, Aspirdrops, Bialpirina, Clariprin

Molecular Formula:	C₉H₈O₄	Molecular Weight:	180.157420 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: BSYNRYMUTXBXSQ-UHFFFAOYSA-N

• Benzamide

IUPAC Name: benzamide | CAS Registry Number: 55-21-0
Synonyms: Benzoylamide, Benzoic acid amide, Phenylcarboxyamide, Phenylcarboxamide, Benzenecarboxamide, Phenyl Carboxyamide, Amid kyseliny benzoove, WLN: ZVR, BENZOIC ACID,AMIDE, Lopac-B-2009, CCRIS 4594, Amid kyseliny benzoove [Czech], Lopac0_000160, HSDB 6360, MLS000069472, 135828_ALDRICH, 150762_ALDRICH, 399337_ALDRICH, ARONIS003511, NSC 3114

Molecular Formula:	C₇H₇NO	Molecular Weight:	121.136580 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: KXDAEFPNCMNJSK-UHFFFAOYSA-N

• Benzene

IUPAC Name: benzene | CAS Registry Number: 71-43-2
Synonyms: benzene, benzol, benzole, Cyclohexatriene, Benzine, Phenyl hydride, Naphtha, Pyrobenzole, Benzolene, Petroleum, Pyrobenzol, Ligroine, Benzin, Mineral naphtha, Coal naphtha, Motor benzol, Carbon oil, Petroleum benzin, Polystream, Asphaltum

Molecular Formula:	C₆H₆	Molecular Weight:	78.111840 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: UHOVQNZJYSORNB-UHFFFAOYSA-N

• Benzene-D6

IUPAC Name: 1,2,3,4,5,6-hexadeuteriobenzene | CAS Registry Number: 1076-43-3
Synonyms: Benzene-d6, Perdeuterobenzene, Hexadeuterobenzene, (2H6)Benzene, ACODAZOLE, 151815_ALDRICH, 175870_ALDRICH, 175978_ALDRICH, 233358_ALDRICH, 236888_ALDRICH, 236977_ALDRICH, 308722_ALDRICH, 364940_ALDRICH, 434515_ALDRICH, 441325_ALDRICH, 442472_SUPELCO, 522104_ALDRICH, 549118_ALDRICH, 561509_ALDRICH, 570680_ALDRICH

Molecular Formula:	C₆H₆	Molecular Weight:	84.148811 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: UHOVQNZJYSORNB-MZWXYZOWSA-N

• Bisphenol-alpha-2,2',6,6'-D4

IUPAC Name: 2,6-dideuterio-4-[2-(3,5-dideuterio-4-hydroxyphenyl)propan-2-yl]phenol | CAS Registry Number: 102438-62-0
Synonyms: Bisphenol-alpha-2,2',6,6'-d4

Molecular Formula:	C₁₅H₁₆O₂	Molecular Weight:	232.315 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: IISBACLAFKSPIT-ULDPCNCHSA-N

• Butanol-D1

IUPAC Name: 1-deuteriooxybutane | CAS Registry Number: 4712-38-3
Synonyms: Butyl alcohol-d, 1-Butan(ol-d), Butan-1-(2H)ol, 175757_ALDRICH, CID20836, Butyl alcohol, titanium (4+) salt, EINECS 225-201-2

Molecular Formula:	C₄H₁₀O	Molecular Weight:	75.127762 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: LRHPLDYGYMQRHN-UICOGKGYSA-N

• Caffeine

IUPAC Name: 1,3,7-trimethylpurine-2,6-dione | CAS Registry Number: 58-08-2
Synonyms: caffeine, Cafeina, Guaranine, Caffein, Koffein, Mateina, Methyltheobromine, Alert-pep, Thein, Cafipel, Theine, Caffedrine, Coffeine, Dexitac, Refresh'n, Stim, Methyltheobromide, Cafamil, Cafecon, Caffine

Molecular Formula:	C₈H₁₀N₄O₂	Molecular Weight:	194.190600 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: RYYVLZVUVIJVGH-UHFFFAOYSA-N

• Campesterol

IUPAC Name: 17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | CAS Registry Number: 474-62-4
Synonyms: Campesterin, Campestrol, 24-epicampesterol, CAMPESTEROL, Ergost-5-en-3.beta.-ol, 24.alpha.-Methylcholesterol, (24S)-beta-Methyl cholesterol, 24-Methylcholest-5-en-3beta-ol, (24R)-5-Ergosten-3.beta.-ol, 5-Cholestene-3-ol, 24-methyl-, CID312822, Ergost-5-en-3-ol, (3.beta.)-, NSC224330, Ergost-5-en-3-ol, (3.beta.,24R)-, Ergost-5-en-3.beta.-ol, (24R)-

Molecular Formula:	C₂₈H₄₈O	Molecular Weight:	400.680120 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: SGNBVLSWZMBQTH-UHFFFAOYSA-N

• Caprolactam

IUPAC Name: azepan-2-one | CAS Registry Number: 105-60-2
Synonyms: epsilon-Caprolactam, 6-Caprolactam, Hexanolactam, 6-Hexanelactam, Aminocaproic lactam, Hexanone isoxime, CAPROLACTAM, hexannic acid, 2-Oxohexamethylenimine, 2-Azacycloheptanone, 2-Perhydroazepinone, azepan-2-one, Kapromine, Stilon, 1,6-Hexolactam, E-caprolactum, Hexahydro-2-azepinone, Caprolactam monomer, gamma-caprolactam, omega-caprolactum

Molecular Formula:	C₆H₁₁NO	Molecular Weight:	113.157640 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: JBKVHLHDHHXQEQ-UHFFFAOYSA-N

• CAPS [3-Cyclohexylamino-1-propanesulfonic Acid]

IUPAC Name: 3-(cyclohexylamino)propane-1-sulfonic acid | CAS Registry Number: 1135-40-6
Synonyms: CAPS, CAPS buffer solution, C2632_SIGMA, C6070_SIGMA, 29337_FLUKA, 82606_FLUKA, 82607_FLUKA, 82608_FLUKA, Buffer solution HPCE pH 10.0, Buffer solution HPCE pH 10.5, Buffer solution HPCE pH 11.0, EINECS 214-492-1, Cyclohexylaminopropanesulfonic acid, 3-(Cyclohexylamino)-1-propanesulfonic acid, BRN 2835588, 3-Cyclohexylaminopropane-1-sulphonic acid, 3-CYCLOHEXYL-1-PROPYLSULFONIC ACID, DB02219, N-Cyclohexyl-3-aminopropanesulfonic acid, 1-Propanesulfonic acid, 3-(cyclohexylamino)-

Molecular Formula:	C₉H₁₉NO₃S	Molecular Weight:	221.317060 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: PJWWRFATQTVXHA-UHFFFAOYSA-N

• Carbamazepine

IUPAC Name: benzo[b][1]benzazepine-11-carboxamide | CAS Registry Number: 298-46-4
Synonyms: carbamazepine, Tegretol, Carbamazepen, Carbamezepine, Carbazepine, Finlepsin, Tegretal, Karbamazepin, Stazepine, Bipotrol, Neurotol, Equetro, Timonil, Biston, Epitol, Lexin, Amizepin, Carbatrol, Telesmin, Tegretol-Xr

Molecular Formula:	C₁₅H₁₂N₂O	Molecular Weight:	236.268580 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: FFGPTBGBLSHEPO-UHFFFAOYSA-N

• Carbamazepine-D10

IUPAC Name: 1,2,3,4,5,6,7,8,9,10-decadeuteriobenzo[b][1]benzazepine-11-carboxamide | CAS Registry Number: 132183-78-9
Synonyms: [2H10]-Carbamazepine, 5H-Dibenz[b,f]azepine-1,2,3,4,6,7,8,9,10,11-d10-5-carboxamide (9CI)

Molecular Formula:	C₁₅H₁₂N₂O	Molecular Weight:	246.330198 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: FFGPTBGBLSHEPO-LHNTUAQVSA-N

• Carbaryl

IUPAC Name: naphthalen-1-yl N-methylcarbamate | CAS Registry Number: 63-25-2
Synonyms: Carbaril, Sevin, CARBARYL, Karbaspray, Carylderm, Menaphtam, Tricarnam, Caprolin, Carbatox, Carbavur, Carpolin, Dicarbam, Karbatox, Karbosep, Arilate, Denapon, Gamonil, Hexavin, Seffein, Septene

Molecular Formula:	C₁₂H₁₁NO₂	Molecular Weight:	201.221240 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: CVXBEEMKQHEXEN-UHFFFAOYSA-N

• Carbendazim

IUPAC Name: methyl N-(1H-benzimidazol-2-yl)carbamate | CAS Registry Number: 10605-21-7
Synonyms: Carbendazole, Mecarzole, Carbendazime, Carbendazol, Bavistin, Thicoper, Derosal, Funaben, Carbendazym, Equitdazin, Falicarben, Pillarstin, Supercarb, Bavistan, Fungisol, Garbenda, Kemdazin, Medamine, Triticol, Agrizim

Molecular Formula:	C₉H₉N₃O₂	Molecular Weight:	191.186660 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: TWFZGCMQGLPBSX-UHFFFAOYSA-N

• Catechol

IUPAC Name: benzene-1,2-diol | CAS Registry Number: 120-80-9
Synonyms: pyrocatechol, catechol, 1,2-benzenediol, pyrocatechin, o-Benzenediol, 1,2-dihydroxybenzene, 2-hydroxyphenol, Pyrocatechine, o-Hydroxyphenol, o-Phenylenediol, o-Dioxybenzene, o-Hydroquinone, Oxyphenic acid, benzenediol, Brenzcatechin, o-Dihydroxybenzene, Phthalhydroquinone, Catechin (phenol), Fouramine PCH, Pelagol Grey C

Molecular Formula:	C₆H₆O₂	Molecular Weight:	110.110640 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: YCIMNLLNPGFGHC-UHFFFAOYSA-N

• Chlorocyclohexane-D11

IUPAC Name: 1-chloro-1,2,2,3,3,4,4,5,5,6,6-undecadeuteriocyclohexane | CAS Registry Number: 119206-70-1
Synonyms: Chlorocyclohexane-d11, SCHEMBL1331738, Chlorocyclohexane-d11, 98 atom % D

Molecular Formula:	C₆H₁₁Cl	Molecular Weight:	129.671 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: UNFUYWDGSFDHCW-KAFHOZLVSA-N

• Chloroethane-1,1,2,2-D4

IUPAC Name: 1-chloro-1,1,2,2-tetradeuterioethane | CAS Registry Number: 25854-33-5
Synonyms: ACM25854335

Molecular Formula:	C₂H₅Cl	Molecular Weight:	68.536 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: HRYZWHHZPQKTII-LNLMKGTHSA-N

• Chloroethane-1,1-D2

IUPAC Name: 1-chloro-1,1-dideuterioethane | CAS Registry Number: 3652-86-6
Synonyms: Chloroethane-1,1-d2, Ethyl-1,1-d2 chloride, 588059_ALDRICH

Molecular Formula:	C₂H₅Cl	Molecular Weight:	66.526424 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: HRYZWHHZPQKTII-CBTSVUPCSA-N

• Chloroethane-2-D1

IUPAC Name: 1-chloro-2-deuterioethane | CAS Registry Number: 23072-56-2
Synonyms: ACM23072562

Molecular Formula:	C₂H₅Cl	Molecular Weight:	65.518 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: HRYZWHHZPQKTII-MICDWDOJSA-N

• Cholesterol-26,26,26,27,27,27-D6

IUPAC Name: (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-7,7,7-trideuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | CAS Registry Number: 60816-17-3
Synonyms: Cholesterol-26,26,26,27,27,27-d6, (26,26,26,27,27,27-2H6)Cholesterol, Cholesterol-26,26,26,27,27,27-d6, 98 atom % D, 97% (CP)

Molecular Formula:	C₂₇H₄₆O	Molecular Weight:	392.701 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: HVYWMOMLDIMFJA-QSOBUISFSA-N

• Cholesterol-3,4-13C2

IUPAC Name: (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | CAS Registry Number: 78887-48-6
Synonyms: 488585_ALDRICH

Molecular Formula:	C₂₇H₄₆O	Molecular Weight:	388.638850 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: HVYWMOMLDIMFJA-WKKCFSIESA-N

• Cholesterol-3-D1

IUPAC Name: (3S,8S,9S,10R,13R,14S,17R)-3-deuterio-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol | CAS Registry Number: 51467-57-3
Synonyms: CHOLESTEROL-3-D1

Molecular Formula:	C₂₇H₄₆O	Molecular Weight:	387.659702 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: HVYWMOMLDIMFJA-BQPALTLPSA-N

• Cholesterol-D7

IUPAC Name: (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | CAS Registry Number: 83199-47-7
Synonyms: Cholesterin-d7, Cholesterol-d7, Cholesterol(d7), Lidinite-d7, Lidinit-d7, Provitamin D-d7, Dythol-d7, (-)-Cholesterol-d7, AC1NSQF4, 5-Cholesten-3|A-ol-d7, Cholest-5-en-3|A-ol-d7, cholest-5-en-3beta-ol(d7), 5:6-Cholesten-3|A-ol-d7, 3|A-Hydroxycholest-5-ene-d7, 7alpha-Hydroxy Cholesterol-D7, CTK8F7338, NSC 8798-d7, (3|A)-Cholest-5-en-3-ol-d7, LMST01010093, AG-H-32358

Molecular Formula:	C₂₇H₄₆O	Molecular Weight:	393.696672 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: HVYWMOMLDIMFJA-IFAPJKRJSA-N

• Clenbuterol-D9

IUPAC Name: 1-(4-amino-3,5-dichlorophenyl)-2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]ethanol | CAS Registry Number: 129138-58-5
Synonyms: Clenbuterol-d9, (+/-)-Clenbuterol D9 (trimethyl D9), 1-(4-amino-3,5-dichlorophenyl)-2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]ethanol, Clenbuterol-(t-butyl-d9), NAB-365Cl, AKOS015888401, FT-0665083, J-005654, I01-10162, Clenbuterol-(t-butyl-d9), 98 atom % D, 97% (CP), 1-(4-Amino-3,5-dichlorophenyl)-2-(tert-butyl-d9-amino)ethanol, 4-Amino-|A-(tert-butyl-d9-aminomethyl)-3,5-dichlorobenzyl alcohol, (+/-)-Clenbuterol D9 (trimethyl D9) 100 ng/microL in Acetonitrile, 4-Amino-3,5-dichloro-|A-[[(1,1-dimethylethyl)amino]methyl]benzenemethanol

Molecular Formula:	C₁₂H₁₈Cl₂N₂O	Molecular Weight:	286.244 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	3

InChIKey: STJMRWALKKWQGH-GQALSZNTSA-N

• Decanoic Acid

IUPAC Name: decanoic acid | CAS Registry Number: 334-48-5
Synonyms: Decanoic acid, n-Capric acid, CAPRIC ACID, n-Decanoic acid, Caprinic acid, Decylic acid, Decoic acid, Caprynic acid, decanoate, n-Decylic acid, n-Decoic acid, caprate, caprinate, Dekansaeure, Kaprinsaeure, n-decanoate, Sodium caprate, Versatic 10, C10 fatty acid, Versatic 10 acid

Molecular Formula:	C₁₀H₂₀O₂	Molecular Weight:	172.264600 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: GHVNFZFCNZKVNT-UHFFFAOYSA-N

• Deuterium Bromide

Synonyms: Deuterium bromide, Bromine, isotope of mass 77, EINECS 236-894-6, CID123313

Molecular Formula:	BrH	Molecular Weight:	80.911825 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: CPELXLSAUQHCOX-FTGQXOHASA-N

• Deuterium Oxide

Synonyms: Heavy water, Deuterated water, DEUTERIUM OXIDE, Dideuterium oxide, Deuteriumoxid, Water-d2, schweres Wasser, Heavy water-d2, Heavy water (D2O), Water(sup 2)-H2, Deuterium oxide [USAN], Water, heavy (D2-O), Deuterium oxide Ultra-D, ((2)H2)water, Deuterium oxide (USAN), 151882_ALDRICH, 151890_ALDRICH, 191701_ALDRICH, 192341_ALDRICH, 269786_ALDRICH

Molecular Formula:	H₂O	Molecular Weight:	20.027604 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: XLYOFNOQVPJJNP-ZSJDYOACSA-N

• Diamyl phthalate

IUPAC Name: dipentyl benzene-1,2-dicarboxylate | CAS Registry Number: 131-18-0
Synonyms: Dipentyl phthalate, Amoil, Amyl phthalate, Di-n-pentyl phthalate, DIAMYL PHTHALATE, Di-n-pentylphthalate, Phthalic acid, dipentyl ester, Phthalic acid, diamyl ester, HSDB 302, Dipentyl 1,2-benzenedicarboxylate, 442867_SUPELCO, NSC 4720, 1,2-Benzenedicarboxylic acid, dipentyl ester, 80154_FLUKA, AI3-00363 (USDA), EINECS 205-017-9, NSC4720, BRN 1987323, LS-739, ZINC01680363

Molecular Formula:	C₁₈H₂₆O₄	Molecular Weight:	306.396640 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: IPKKHRVROFYTEK-UHFFFAOYSA-N

• Diethyl phthalate

IUPAC Name: diethyl benzene-1,2-dicarboxylate | CAS Registry Number: 84-66-2
Synonyms: DIETHYL PHTHALATE, Neantine, Phthalol, Solvanol, Anozol, Ethyl phthalate, Palatinol A, Placidol E, Unimoll DA, Diethylphthalate, solvano l, Diethyl o-phthalate, Di-n-ethyl phthalate, Phthalic acid, diethyl ester, Estol 1550, Diethyl o-phenylenediacetate, Phthalsaeurediaethylester, Diethyl Phthalate [USAN], RCRA waste no. U088, Diethyl phthalate (NF)

Molecular Formula:	C₁₂H₁₄O₄	Molecular Weight:	222.237160 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: FLKPEMZONWLCSK-UHFFFAOYSA-N