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Chempure

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Profile: Chempure is involved in the business of chemicals. We provide bio-chemical, fine, organic and specialty research chemicals. Our products include abietic acid, 2-cis-4-trans-abscisic acid, 2-acetamido-5-aminopyridine, 2-amino-4-chloro-6-methylpyrimidine, barium acetate, barium bromate, cadmium carbonate, cadmium sulfate octahydrate, 3-decanone, 2,5-difluorotoluene, 3,4-(ethylenedioxy)benzeneboronic acid and 3-ethyl-3-hexanol.

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• 1-(tert-Butoxycarbonyl)indole-2-boronic acid
IUPAC Name: [1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid | CAS Registry Number: 213318-44-6
Synonyms: N-Boc-indole-2-boronic acid, 1-Boc-indole-2-boronic acid, ZERO/004903, 675911_ALDRICH, B2000G1, CID2773302, N-(tert-butoxycarbonyl)indole-2-boronic acid, TL80073575, 1-(tert-butoxycarbonyl)indole-2-boronic acid, [N-(tert-Butoxycarbonyl)indol-2-yl]boronic acid, A4137/0176383

Molecular Formula: C13H16BNO4Molecular Weight: 261.081440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: SVIBPSNFXYUOFT-UHFFFAOYSA-N

• 2,2,3,3-Tetrafluoro-1,4-butanediol
IUPAC Name: 2,2,3,3-tetrafluorobutane-1,4-diol | CAS Registry Number: 425-61-6
Synonyms: NCIOpen2_001518, 567191_ALDRICH, ZINC01615584, NSC95113, CID136270

Molecular Formula: C4H6F4O2Molecular Weight: 162.082853 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: CDZXJJOGDCLNKX-UHFFFAOYSA-N

• (S)-(+)-N,S-Dimethyl-S-Phenylsulfoximine
IUPAC Name: methyl-methylimino-oxo-phenyl-$l^{6}-sulfane | CAS Registry Number: 33993-53-2
Synonyms: CTK4H1572, ZINC12341540, AG-F-15218, Methanamine,N-[(S)-methyloxidophenyl-l4-sulfanylidene]-, Sulfoximine,N,S-dimethyl-S-phenyl-, (S)-; Sulfoximine, N,S-dimethyl-S-phenyl-, (S)-(+)-(8CI); Sulfoximine, N,S-dimethyl-S-phenyl-, [S(S)]- (9CI);(S)-(+)-N,S-Dimethyl-S-phenylsulfoximine; (S)-N,S-Dimethyl-S-phenylsulfoximine

Molecular Formula: C8H11NOSMolecular Weight: 169.244040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: OQWUXWSLVBGOIX-NSHDSACASA-N

• 1,4-diethoxybenzene
IUPAC Name: 1,4-diethoxybenzene | CAS Registry Number: 122-95-2
Synonyms: p-Diethoxybenzene, 1,4-Diethoxybenzene, Benzene, p-diethoxy-, Benzene, 1,4-diethoxy-, Hydroquinone diethyl ether, Hydroquinone diethylether, Benzene, p-diethoxy- (8CI), 544213_ALDRICH, NSC2113, NSC 2113, NSC68808, EINECS 204-585-5, ZINC00394919, AI3-09458, ST5406047, InChI=1/C10H14O2/c1-3-11-9-5-7-10(8-6-9)12-4-2/h5-8H,3-4H2,1-2H

Molecular Formula: C10H14O2Molecular Weight: 166.216960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VWGNFIQXBYRDCH-UHFFFAOYSA-N

• 2,3-dichlorobromobenzene
IUPAC Name: 1-bromo-2,3-dichlorobenzene | CAS Registry Number: 56961-77-4
Synonyms: 1-BROMO-2,3-DICHLOROBENZENE, 280089_ALDRICH, Benzene, 1-bromo-2,3-dichloro-, EINECS 260-476-2, CID42066, FS000808, ST5405338, InChI=1/C6H3BrCl2/c7-4-2-1-3-5(8)6(4)9/h1-3

Molecular Formula: C6H3BrCl2Molecular Weight: 225.898020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: HVKCZUVMQPUWSX-UHFFFAOYSA-N

• 1-Bromoperfluoroheptane
IUPAC Name: 1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptane | CAS Registry Number: 375-88-2
Synonyms: Perfluoroheptyl bromide, Perfluoro-n-heptyl bromide, 1-Bromopentadecafluoroheptane, CID67819, EINECS 206-799-4, Heptane, 1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoro-

Molecular Formula: C7BrF15Molecular Weight: 448.954948 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 15

InChIKey: VPQQZKWYZYVTMU-UHFFFAOYSA-N

• (S)-(+)-3,4,8,8a-Tetrahydro-8a-Methyl-1,6(2h,7h)-Naphthalenedione
IUPAC Name: 8a-methyl-3,4,7,8-tetrahydro-2H-naphthalene-1,6-dione | CAS Registry Number: 33878-99-8
Synonyms: Wieland-Michler ketone, Miescher-Wieland ketone, Wieland-Miescher ketone, M65157_ALDRICH, NSC87581, CID89262, EINECS 243-463-6, LT00233231, 9-(S)-Methyl-.delta.-5(10)-octalin-1,6-dione, 9(S)-Methyl-delta-5(10)-octalin-1,6-dione, (+/-)-9-Methyl-5(10)-octaline-1,6-dione, 8a-Methyl-3,4,8,8a-tetrahydro-1,6(2H,7H)-naphthalenedione, 8a-methyl-3,4,7,8-tetrahydro-2H-naphthalene-1,6-quinone, 3,4,8,8a-Tetrahydro-8a-methyl-(2H,7H)naphthalene-1,6-dione, 1,6(2H,7H)-Naphthalenedione, 3,4,8,8a-tetrahydro-8a-methyl-, (+/-)-8a-Methyl-3,4,8,8a-tetrahydro-1,6(2H,7H)-naphthalenedione, 20007-72-1

Molecular Formula: C11H14O2Molecular Weight: 178.227660 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DNHDRUMZDHWHKG-UHFFFAOYSA-N

• 1-Hydroxyadamantane
IUPAC Name: adamantan-1-ol | CAS Registry Number: 768-95-6
Synonyms: 1-Adamantanol, 1-Adamantol, Adamantan-1-ol, Ambap2129, 130346_ALDRICH, 54191_FLUKA, EINECS 212-202-8, NSC 91633, NSC 108837, Tricyclo(3.3.1.13,7)decan-1-ol, NSC91633, NSC108837, ZINC01297856, Tricyclo[3.3.1.1(3,7)]decan-1-ol, AI3-61285, SDCCGMLS-0066229.P001, Tricyclo[3.3.1.13,7]decan-1-ol, LS-15042, tricyclo[3.3.1.1~3,7~]decan-1-ol, ST5182315

Molecular Formula: C10H16OMolecular Weight: 152.233440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VLLNJDMHDJRNFK-UHFFFAOYSA-N

• 3-Bromo(trifluoromethoxy)benzene
IUPAC Name: 1-bromo-3-(trifluoromethoxy)benzene | CAS Registry Number: 2252-44-0
Synonyms: 3-(Trifluoromethoxy)bromobenzene, 343870_ALDRICH, 1-Bromo-3-(trifluoromethoxy)benzene, JRD-0317, ZINC00056741, ST5306897, TL8001889, Anisole, m-bromo-.alpha..alpha..alpha.-trifluoro-, InChI=1/C7H4BrF3O/c8-5-2-1-3-6(4-5)12-7(9,10)11/h1-4

Molecular Formula: C7H4BrF3OMolecular Weight: 241.005270 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: WVUDHWBCPSXAFN-UHFFFAOYSA-N

• 1,2,4-Benzenetriol
IUPAC Name: benzene-1,2,4-triol | CAS Registry Number: 533-73-3
Synonyms: Hydroxyquinol, Hydroxyhydroquinone, 1,2,4-BENZENETRIOL, Oxyhydroquinone, 1,2,4-Trihydroxybenzene, Benzene-1,2,4-triol, 4-Hydroxycatechol, 2,5-Dihydroxyphenol, Hydroquinone, hydroxy-, Ambap71, 1,3,4-Benzenetriol, 1,3,4-Trihydroxybenzene, Oxyhydrochinon [German], WLN: QR BQ DQ, CCRIS 2987, 173401_ALDRICH, NSC 2818, CHEBI:16971, EINECS 208-575-1, NSC2818

Molecular Formula: C6H6O3Molecular Weight: 126.110040 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: GGNQRNBDZQJCCN-UHFFFAOYSA-N

• (S,S)-(-)-Hydrobenzoin
IUPAC Name: (1S,2S)-1,2-diphenylethane-1,2-diol | CAS Registry Number: 2325-10-2
Synonyms: meso-Stilbene glycol, 256269_ALDRICH, (S,S)-1,2-Diphenylethylene glycol, CID853020, ZINC00388745, (S,S)-(-)-1,2-Diphenyl-1,2-ethanediol, InChI=1/C14H14O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13-16

Molecular Formula: C14H14O2Molecular Weight: 214.259760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: IHPDTPWNFBQHEB-KBPBESRZSA-N

• 1,2,4-Trimethoxybenzene
IUPAC Name: 1,2,4-trimethoxybenzene | CAS Registry Number: 135-77-3
Synonyms: Benzene, 1,2,4-trimethoxy-, T68802_ALDRICH, EINECS 205-219-7, Hydroxyhydroquinone trimethyl ether, EPA Pesticide Chemical Code 040515, ZINC00391982, AI3-20797, NCGC00164023-01, LS-32250, ST5406125, TL8000835

Molecular Formula: C9H12O3Molecular Weight: 168.189780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: AGIQIOSHSMJYJP-UHFFFAOYSA-N

• 1-benzyl-3-piperidone Hydrochloride Hydrate
IUPAC Name: 1-(phenylmethyl)piperidin-1-ium-3-one | CAS Registry Number: 50606-58-1
Synonyms: ZINC00119573, CID3527570

Molecular Formula: C12H16NO+Molecular Weight: 190.261540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: BBQQULRBTOMLTC-UHFFFAOYSA-O

• 1H,1H,5H-Octafluoropentyl acrylate
IUPAC Name: 2,2,3,3,4,4,5,5-octafluoropentyl prop-2-enoate | CAS Registry Number: 376-84-1
Synonyms: 474401_ALDRICH, EINECS 206-816-5, 2,2,3,3,4,4,5,5-Octafluoropentyl acrylate, LS-192524, 2-Propenoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester

Molecular Formula: C8H6F8O2Molecular Weight: 286.119266 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 10

InChIKey: WISUNKZXQSKYMR-UHFFFAOYSA-N

• 1,3-Di(4-piperidyl)propane 4,4-Trimethyiene piperidinopiperidine
IUPAC Name: 4-(3-piperidin-4-ylpropyl)piperidine | CAS Registry Number: 16898-52-5
Synonyms: DI-PIP, Piperid Pr-bis deriv., 4,4'-Trimethylenedipiperidine, 1,3-Di-4-piperidylpropane, Maybridge4_003634, 1,3-Bis(4-piperidyl)propane, Oprea1_445285, Piperidine, 4,4'-trimethylenedi-, 1,3-Di(4-Piperidyl)propane, 121207_ALDRICH, Piperidine, 4,4'-(1,3-propanediyl)bis-, AIDS006073, 4,4'-(1,3-Propanediyl)bispiperidine, AIDS-006073, NSC96364, EINECS 240-941-6, NSC 96364, 1,3-BIS-4-PIPERIDYL PROPANE, 4,4'-(1,3-Propanediyl)bis(piperidine), Piperidine, 4,4'-trimethylenedi- (8CI)

Molecular Formula: C13H26N2Molecular Weight: 210.358940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: OXEZLYIDQPBCBB-UHFFFAOYSA-N

• (S)-N-Benzyl-3-Acetylamino Pyrrolidine
IUPAC Name: N-(1-benzylpyrrolidin-3-yl)acetamide | CAS Registry Number: 114636-30-5
Synonyms: 1-Benzyl-3-acetamidopyrrolidine, 28506-01-6, N-Benzyl-3-(Acetylamino)pyrrolidine, N-(1-benzylpyrrolidin-3-yl)acetamide, ACMC-20abrp, PubChem11218, ACMC-20api0, AC1N5OHN, ACMC-1CH1T, SureCN7393471, 3-Acetamido-1-benzylpyrrolidine, AGN-PC-000G51, CTK4G1610, ANW-26408, AKOS009071485, AG-E-91620, MCULE-3793424645, KB-152205, B1355, FT-0607395

Molecular Formula: C13H18N2OMolecular Weight: 218.294820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CMSWETNAAPYFSH-UHFFFAOYSA-N

• (2-Chloroethyl)triphenylphosphonium bromide
IUPAC Name: 2-chloroethyl(triphenyl)phosphanium bromide | CAS Registry Number: 31238-20-7
Synonyms: EINECS 250-527-7, CID3084530, 2-Chloroethyltriphenylphosphonium bromide

Molecular Formula: C20H19BrClPMolecular Weight: 405.695621 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: HETXOZDAMZALJQ-UHFFFAOYSA-M

• 1-Bromo-4-iodobenzene
IUPAC Name: 1-bromo-4-iodobenzene | CAS Registry Number: 589-87-7
Synonyms: p-Bromoiodobenzene, p-Iodobromobenzene, p-Bromophenyl iodide, Benzene, 1-bromo-4-iodo-, 4-BROMOIODOBENZENE, 238090_ALDRICH, NSC8033, NSC 8033, EINECS 209-662-7, BBV-080402, AI3-09032, InChI=1/C6H4BrI/c7-5-1-3-6(8)4-2-5/h1-4

Molecular Formula: C6H4BrIMolecular Weight: 282.904430 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: UCCUXODGPMAHRL-UHFFFAOYSA-N

• 1-(2-Nitrophenyl)Pyrrole
IUPAC Name: 1-(2-nitrophenyl)pyrrole | CAS Registry Number: 33265-60-0
Synonyms: 1-(2-Nitrophenyl)pyrrole, Maybridge1_002734, 1-(2-Nitrophenyl)-1H-pyrrole, DivK1c_001486, CDS1_000446, CID520611, ZINC00138067, CD03294, SR-01000643964-1

Molecular Formula: C10H8N2O2Molecular Weight: 188.182720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: UQNRTIQURQZGKL-UHFFFAOYSA-N

• 2-Bromo-4,6-difluoroiodobenzene
IUPAC Name: 1-bromo-3,5-difluoro-2-iodobenzene | CAS Registry Number: 175278-11-2
Synonyms: 1-Bromo-3,5-difluoro-2-iodobenzene, 3,5-difluoro-2-iodobromobenzene, PubChem3212, AC1LASDB, SureCN4607963, CTK4D5843, MolPort-000-151-920, ACT12689, ANW-72579, ZINC00167274, AKOS009157596, AG-E-25713, AM61370, AS03205, Benzene,1-bromo-3,5-difluoro-2-iodo-, AK-33728, Benzene, 1-bromo-3,5-difluoro-2-iodo-, KB-21258, FT-0611435, ST51051949

Molecular Formula: C6H2BrF2IMolecular Weight: 318.885356 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: KJJGFGWQNCPZBG-UHFFFAOYSA-N

• 10,12-Tricosadiynoic acid
IUPAC Name: tricosa-10,12-diynoic acid | CAS Registry Number: 66990-30-5
Synonyms: tricosa-10,12-diynoic acid, SBB009036, AC1LBMJG, 10,12-Tricosadiynoicacid, ACMC-209nx8, Tricosa-10,12-diynoicacid, 91445_ALDRICH, AC1Q5W79, 91445_FLUKA, CTK2F2370, MolPort-003-939-688, ANW-35274, AR-1C0050, AKOS015839844, AG-G-53012, FT-0607184, I04-1671

Molecular Formula: C23H38O2Molecular Weight: 346.546620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DIEDVCMBPCRJFQ-UHFFFAOYSA-N

• 1-(Phenylsulfonyl)indole
IUPAC Name: 1-phenylsulfonylindole | CAS Registry Number: 40899-71-6
Synonyms: 1-(Phenylsulfonyl)-1H-indole, CBDivE_002895, MLS000104364, 366633_ALDRICH, ARONIS001276, IFLab1_005965, NSC683530, AIDS149292, AIDS-149292, NSC237040, IDI1_011368, SMR000054299, ST039848, AG-690/12868319

Molecular Formula: C14H11NO2SMolecular Weight: 257.307640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VDWLCYCWLIKWBV-UHFFFAOYSA-N

• 1,6-Dibromo-2-hydroxynaphthalene-3-carboxylic acid
IUPAC Name: 4,7-dibromo-3-hydroxynaphthalene-2-carboxylic acid | CAS Registry Number: 1779-10-8
Synonyms: 638528_ALDRICH, NSC8508, NSC 8508, NSC50642, EINECS 217-214-7, NSC 50642, 2-Naphthoic acid, 4,7-dibromo-3-hydroxy-, 4,7-Dibromo-3-hydroxy-2-naphthoic acid, 2-Naphthalenecarboxylic acid, 4,7-dibromo-3-hydroxy-

Molecular Formula: C11H6Br2O3Molecular Weight: 345.971540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WNMKUIQCIRAXBN-UHFFFAOYSA-N

• 1,3-CyclohexaneDione
IUPAC Name: cyclohexane-1,3-dione | CAS Registry Number: 504-02-9
Synonyms: Dihydroresorcinol, 1,3-Cyclohexanedione, Hydroresorcinol, 1,3-Cyclohexanone, Resorcinol, dihydro-, 1,3-Cyclohexandione, 1,3 Cyclohexanedione, CYCLOHEXANE-1,3-DIONE, 1,3-Benzenediol, dihydro-, WLN: L6V CVTJ, Benzil-related compound, 49, CYCLOHEXANE-13-DIONE, C101605_ALDRICH, 29059_FLUKA, CHEBI:17766, CID10434, NSC57477, EINECS 207-980-0, NSC 57477, SB 01019

Molecular Formula: C6H8O2Molecular Weight: 112.126520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: HJSLFCCWAKVHIW-UHFFFAOYSA-N

• 4-Bromophenyl trifluoromethyl sulphide
IUPAC Name: 1-bromo-4-(trifluoromethylsulfanyl)benzene | CAS Registry Number: 333-47-1
Synonyms: 555495_ALDRICH, ZINC00158098, 4-(Trifluoromethylthio)bromobenzene, CID736413, ST5306932

Molecular Formula: C7H4BrF3SMolecular Weight: 257.070870 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: CQQBVMXLTBXNLB-UHFFFAOYSA-N

• 1,4-Cyclohexandione
IUPAC Name: cyclohexane-1,4-dione | CAS Registry Number: 637-88-7
Synonyms: 1,4-Cyclohexanedione, TETRAHYDROQUINONE, 1,4-Dioxocyclohexane, Cyclohexane-1,4-dione, 125423_ALDRICH, 29070_FLUKA, CHEBI:28286, NSC7192, NSC 7192, EINECS 211-306-0, c0554, STK335618, ZINC03860985, FR-2390, AI3-22410, TL8004488, C08063, InChI=1/C6H8O2/c7-5-1-2-6(8)4-3-5/h1-4H

Molecular Formula: C6H8O2Molecular Weight: 112.126520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DCZFGQYXRKMVFG-UHFFFAOYSA-N

• 1,2-Bis(Diphenylphosphino) Ethane (Diphos)
IUPAC Name: 2-di(phenyl)phosphanylethyl-di(phenyl)phosphane | CAS Registry Number: 1663-45-2
Synonyms: Diphos, DPPE, Bis(diphenylphosphine)ethane, Ethylenebis(diphenylphosphine), Phosphine, ethylenebis[diphenyl-, 1,2-Bis(diphenylphosphino)ethane, Bis(1,2-diphenylphosphino)ethane, 106496_ALDRICH, 376728_ALDRICH, 14823_FLUKA, CHEBI:30669, 1,2-Bis(diphenylphosphine)ethane, 1,2-bis(diphenylphosphino)-ethane, NSC76285, EINECS 216-769-2, P,P'-Ethylenebis(diphenylphosphine), PHOSPHINE, 1,2-ETHANEDIYLBIS[DIPHENYL-, 1,2-Ethanediylbis(diphenylphosphine), ethane-1,2-diylbis(diphenylphosphane), Phosphine, 1,2-ethanediylbis(diphenyl-

Molecular Formula: C26H24P2Molecular Weight: 398.416282 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: QFMZQPDHXULLKC-UHFFFAOYSA-N

• 1-Thio-beta-D-glucose tetraacetate
IUPAC Name: [4,5-diacetyloxy-2-(acetyloxymethyl)-6-sulfanyloxan-3-yl] acetate | CAS Registry Number: 19879-84-6
Synonyms: NSC97032, .beta.-D-Glucopyranose, 1-thio-, 2,3,4,6-tetraacetate

Molecular Formula: C14H20O9SMolecular Weight: 364.368200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 9

InChIKey: SFOZKJGZNOBSHF-UHFFFAOYSA-N

• 1-iodononane
IUPAC Name: 1-iodononane | CAS Registry Number: 4282-42-2
Synonyms: n-Nonyl iodide, Nonyl iodide, 1-Iodononane, Nonane, 1-iodo-, 1-n-Nonyl iodide, IODONONANE, 251860_ALDRICH, NSC5520, NSC 5520, EINECS 224-286-3, 6683-07-4

Molecular Formula: C9H19IMolecular Weight: 254.151630 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: OGSJMFCWOUHXHN-UHFFFAOYSA-N

• 2,5-dibromo nitrobenzene
IUPAC Name: 1,4-dibromo-2-nitrobenzene | CAS Registry Number: 3460-18-2
Synonyms: 2,5-Dibromonitrobenzene, 1,4-Dibromo-2-nitrobenzene, D42003_ALDRICH, Benzene, 1,4-dibromo-2-nitro-, ZINC02166805, CID77004, EINECS 222-404-8, ST5319426, TL8006912, T6039496

Molecular Formula: C6H3Br2NO2Molecular Weight: 280.901520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WRGKKASJBOREMB-UHFFFAOYSA-N

• (-)-DIOP
IUPAC Name: [5-[di(phenyl)phosphanylmethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-di(phenyl)phosphane | CAS Registry Number: 32305-98-9
Synonyms: NSC699412, AIDS153218, AIDS-153218, EINECS 250-984-2, NCI60_035591, (-)-2,2-Dimethyl-4,5-((diphenylphosphino)dimethyl)dioxolane, (+)-2,3-O-Isopropylidene-2,3-dihydroxy-1,4-bis(diphenylphosphino)butane, 2,3,O-Isopropylidene-2,3-dihydroxy-1,4-bis(diphenylphosphino)butane, ((5-((Diphenylphosphino)methyl)-2,2-dimethyl-1,3-dioxolan-4-yl)methyl)(diphenyl)phosphine, (-)-1,4-Bis(diphenylphosphino)-1,4-dideoxy-2,3-O-isopropylidene-L-threitol, Phosphine, [(2,2-dimethyl-1,3-dioxolane-4,5-diyl)bis(methylene)]bis[diphenyl-, (4S-trans)-

Molecular Formula: C31H32O2P2Molecular Weight: 498.532102 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VCHDBLPQYJAQSQ-UHFFFAOYSA-N

• 1-BromoAdamantane
IUPAC Name: 1-bromoadamantane | CAS Registry Number: 768-90-1
Synonyms: 1-Bromoadamantane, Adamantyl bromide, 1-Adamantyl bromide, Adamantane, 1-bromo-, Maybridge1_002156, 1-BROMO ADAMANTANE, ADAMANTANE,1-BROMO, 109223_ALDRICH, 16130_FLUKA, EINECS 212-200-7, CID79106, 1-Bromotricyclo(3.3.1.13,7)decane, EINECS 230-777-3, NSC527914, 2-Bromotricyclo(3.3.1.13,7)decane, STT-00320130, LS-185689, ST5182329, TL8005279, Tricyclo[3.3.1.1(3,7)-]decane, 1-bromo-

Molecular Formula: C10H15BrMolecular Weight: 215.130100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: VQHPRVYDKRESCL-UHFFFAOYSA-N

• (Tert-Buloxycarbonylmethyl)Triphenylphosphonium Chloride
IUPAC Name: [2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-triphenylphosphanium;chloride | CAS Registry Number: 35000-37-4
Synonyms: (tert-Butoxycarbonylmethyl)triphenylphosphonium chloride, AG-F-20240, ACMC-1AHM8, 20423_ALDRICH, 20423_FLUKA, CTK3J6430, AKOS015833185, FT-0605351, ST50408128, TL80073964, (BOC-METHYL)TRIPHENYLPHOSPHONIUM CHLORIDE, I14-115640, (Carboxymethyl)triphenylphosphoniumchloride, tert-butyl ester (7CI); Phosphonium,[2-(1,1-dimethylethoxy)-2-oxoethyl]triphenyl-, chloride (9CI);(tert-Butoxycarbonylmethyl)triphenylphosphonium chloride

Molecular Formula: C24H26ClO2PMolecular Weight: 412.888802 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: PWEGQXPODNSKMU-UHFFFAOYSA-M

• 4-Bromophenylacetylene
IUPAC Name: 1-bromo-4-ethynylbenzene | CAS Registry Number: 766-96-1
Synonyms: 1-Bromo-4-ethynylbenzene, Benzene, 1-bromo-4-ethynyl-, 206512_ALDRICH, CID136603, B180, ST5408831, InChI=1/C8H5Br/c1-2-7-3-5-8(9)6-4-7/h1,3-6

Molecular Formula: C8H5BrMolecular Weight: 181.029300 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: LTLVZQZDXQWLHU-UHFFFAOYSA-N

• 1,4-Diamino Anthraquinone
IUPAC Name: 1,4-diaminoanthracene-9,10-dione | CAS Registry Number: 128-95-0
Synonyms: Krisolamine, Grasol Violet R, Seacyl Violet R, Setacyl Violet R, Oil Violet R, Acetate Red Violet R, Disperse Violet K, Disperse violet 1, Gracet Violet 2R, Oracet Violet 2R, Resiren Violet TR, Setile Violet 3R, Cibacet Violet 2R, Duranol Violet 2R, Nacelan Violet 4R, Amacel heliotrope R, Dispersive Violet K, Cibacete Violet 2R, Perliton Violet 3R, Solvent Violet 11

Molecular Formula: C14H10N2O2Molecular Weight: 238.241400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: FBMQNRKSAWNXBT-UHFFFAOYSA-N

• 1-Bromo-4-chloro-2-fluorobenzene
IUPAC Name: 1-bromo-4-chloro-2-fluorobenzene | CAS Registry Number: 1996-29-8
Synonyms: 532703_ALDRICH, ST5405133, TL800742107

Molecular Formula: C6H3BrClFMolecular Weight: 209.443423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: FPNVMCMDWZNTEU-UHFFFAOYSA-N

• 1, 4 -Phenylene Diacetic Acid
IUPAC Name: 2-[4-(carboxymethyl)phenyl]acetic acid | CAS Registry Number: 7325-46-4
Synonyms: p-Phenylenediacetic acid, 1,4-Phenylenediacetic acid, 1.4-Phenylenediacetic acid, P23407_ALDRICH, 78470_FLUKA, CID81760, EINECS 230-801-2, ST5437185

Molecular Formula: C10H10O4Molecular Weight: 194.184000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: SLWIPPZWFZGHEU-UHFFFAOYSA-N

• 3-Aminopyrrolidine dihydrochloride
IUPAC Name: [(3R)-pyrrolidin-1-ium-3-yl]azanium | CAS Registry Number: 103831-11-4
Synonyms: ZINC04682891

Molecular Formula: C4H12N2+2Molecular Weight: 88.151480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 0

InChIKey: NGXSWUFDCSEIOO-SCSAIBSYSA-P

• (S)-4-Hydroxymethyl butyrolactone
IUPAC Name: 5-(hydroxymethyl)oxolan-2-one | CAS Registry Number: 32780-06-6
Synonyms: (S)-(+)-2',3'-Dideoxyribonolactone, 5-Hydroxymethyldihydrofuran-2-one, NSC128380, 5-(Hydroxymethyl)dihydro-2(3H)-furanone, NSC 128380, 2(3H)-Furanone, dihydro-5-(hydroxymethyl)-, 10374-51-3

Molecular Formula: C5H8O3Molecular Weight: 116.115220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: NSISJFFVIMQBRN-UHFFFAOYSA-N

• 1,2-Dihydroxy methyl Benzene
IUPAC Name: [2-(hydroxymethyl)phenyl]methanol | CAS Registry Number: 612-14-6
Synonyms: 1,2-Benzenedimethanol, Phthalyl alcohol, o-Xylene-alpha,alpha'-diol, 1,2-phenylenedimethanol, 2-Hydroxymethylbenzenemethanol, 1,2-Bis(hydroxymethyl)benzene, 184829_ALDRICH, 12570_FLUKA, CID69153, EINECS 210-293-9, NSC403013, ZINC03861341, NSC 403013, AI3-19549, InChI=1/C8H10O2/c9-5-7-3-1-2-4-8(7)6-10/h1-4,9-10H,5-6H, 6680-73-5

Molecular Formula: C8H10O2Molecular Weight: 138.163800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: XMUZQOKACOLCSS-UHFFFAOYSA-N

• 1-Chloro-2-iodo-1,1,2-trifluoroethane
IUPAC Name: 1-chloro-1,1,2-trifluoro-2-iodoethane | CAS Registry Number: 354-26-7
Synonyms: EINECS 206-553-6, 1-Chloro-1,1,2-trifluoro-2-iodoethane, Ethane, 1-chloro-1,1,2-trifluoro-2-iodo-

Molecular Formula: C2HClF3IMolecular Weight: 244.382020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XONGRFUEHPBOBB-UHFFFAOYSA-N

• (2s,3s)-(-)-2,3-Butanediol Di-P-Tosylate
IUPAC Name: [(2S,3S)-3-(4-methylphenyl)sulfonyloxybutan-2-yl] 4-methylbenzenesulfonate | CAS Registry Number: 74839-83-1
Synonyms: (-)-2,3-Butanediyl di(p-toluenesulfonate), (-)-2,3-Butanediol di-p-tosylate, 310522_ALDRICH, CTK8F1385, AG-G-97840, FT-0604669, 2,3-Butanediol,bis(4-methylbenzenesulfonate), [S-(R*,R*)]- (9CI)

Molecular Formula: C18H22O6S2Molecular Weight: 398.493680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: MFRBMNNZDFDJOF-HOTGVXAUSA-N

• 1,8-Naphthalic Anhydride
Synonyms: Protect, Pakarli, 1,8-Naphthalic anhydride, Naphthalic anhydride, Naphthalic acid anhydride, Protect (agrochemical), 1,8-Naphthalic acid anhydride, N1607_ALDRICH, Naphthalic anhydride (7CI,8CI), NSC 5747, 70320_FLUKA, EINECS 201-380-2, HSDB 7371, 1H,3H-Naphtho[1,8-cd]pyran-1,3-dione, NSC5747, WLN: T666 1A M CVOVJ, Naphthalene-1,8-dicarboxylic anhydride, 1,8-Naphthalenedicarboxylic acid anhydride, 1H,3H-Benzo[de]isochromene-1,3-dione, BRN 0153190

Molecular Formula: C12H6O3Molecular Weight: 198.174240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: GRSMWKLPSNHDHA-UHFFFAOYSA-N

• (1-Decyl)triphenylphosphonium bromide
IUPAC Name: decyl(trimethyl)azanium bromide | CAS Registry Number: 2082-84-0
Synonyms: DTAB, Decyltrimethylammonium bromide, n-Decyltrimethylammonium bromide, Trimethyldecylammonium bromide, FSM 20, Ammonium, decyltrimethyl-, bromide, NSC 9951, 30725_FLUKA, EINECS 218-219-7, N,N,N-Trimethyl-1-decanaminium bromide, N,N,N-Trimethyldecylammonium bromide, NSC9951, 1-Decanaminium, N,N,N-trimethyl-, bromide, DECYLTRIMETHYL AMMONIUM BROMIDE, AI3-61499, LS-17295, 15053-09-5

Molecular Formula: C13H30BrNMolecular Weight: 280.288000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: PLMFYJJFUUUCRZ-UHFFFAOYSA-M

• (S)-1-Amino-1,2,3,4-tetrahydronaphthalene
IUPAC Name: (1S)-1,2,3,4-tetrahydronaphthalen-1-amine | CAS Registry Number: 23357-52-0
Synonyms: (S)-1,2,3,4-tetrahydro-1-naphthylamine, (S)-(+)-1,2,3,4-Tetrahydro-1-naphthylamine, (1S)-1,2,3,4-tetrahydronaphthalen-1-amine, (S)-(+)-1-Aminotetraline, (S)-1-AMINOTETRALINE, (S)-1,2,3,4-Tetrahydronaphthalen-1-amine, (S)-(+)-1-AminoTetralin(R), AG-E-59737, (S)-1-Amino-1,2,3,4-tetrahydro-naphthalene, (S)-(+)-1-Amino-1,2,3,4-tetrahydronaphthalene, (S)-1-AMINO-1,2,3,4-TETRAHYDRONAPHTHALENE, (S)-(+)-1,2,3,4-TETRAHYDRO-NAPHTHALEN-1-YLAMINE, 1,2,3,4-Tetrahydro-naphthalen-1-ylamine, AC1OEJUP, PubChem11534, S-THAN, SureCN44600, AC1Q4UC1, (S)-1-AMINOTETRALIN, CHEMBL39537

Molecular Formula: C10H13NMolecular Weight: 147.216920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JRZGPXSSNPTNMA-JTQLQIEISA-N

• 1-(2-Thiazolylazo)-2-naphthol
IUPAC Name: 1-(1,3-thiazol-2-ylhydrazinylidene)naphthalen-2-one | CAS Registry Number: 1147-56-4
Synonyms: 1-(2-Thiazoylazo)-2-naphthol, ZINC04187051, 2-Naphthol, 1-(2-thiazolylazo)-, NSC139021, 2-Naphthalenol, 1-(2-thiazolylazo)-, CID5382380

Molecular Formula: C13H9N3OSMolecular Weight: 255.295060 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: GCBAKGGJQPMJLL-UHFFFAOYSA-N

• 1H,1H,5H-Octafluoropentyl methacrylate
IUPAC Name: 2,2,3,3,4,4,5,5-octafluoropentyl 2-methylprop-2-enoate | CAS Registry Number: 355-93-1
Synonyms: 470988_ALDRICH, EINECS 206-596-0, Octafluoropentyl methacrylate polymer, 2,2,3,3,4,4,5,5-Octafluoropentyl methacrylate, 2-Propenoic acid, 2-methyl-, 2,2,3,3,4,4,5,5-octafluoropentyl ester, 2-Propenoic acid, 2-methyl-, 2,2,3,3,4,4,5,5-octafluoropentyl ester, homopolymer, 30998-06-2

Molecular Formula: C9H8F8O2Molecular Weight: 300.145846 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 10

InChIKey: ZNJXRXXJPIFFAO-UHFFFAOYSA-N

• 2,5-Dichlorofluorobenzene
IUPAC Name: 1,4-dichloro-2-fluorobenzene | CAS Registry Number: 348-59-4
Synonyms: Benzene,1,4-dichloro-2-fluoro-, Benzene, 1,4-dichloro-2-fluoro-, NSC10256, ST5405137, TL8002599

Molecular Formula: C6H3Cl2FMolecular Weight: 164.992423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BJQTYCQGIXZSNM-UHFFFAOYSA-N

• 1,6-Dimethoxy naphthalene
IUPAC Name: 1,6-dimethoxynaphthalene | CAS Registry Number: 3900-49-0
Synonyms: 1,6-Dimethoxynaphthalene, Maybridge3_002840, 579254_ALDRICH, NSC167477, ZINC00160992, IDI1_014227, ST5408360

Molecular Formula: C12H12O2Molecular Weight: 188.222480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RBUFUWIWCCOVOS-UHFFFAOYSA-N

• (3-Bromopropyl)Triphenylphosphonium Bromide
IUPAC Name: 3-bromopropyl(triphenyl)phosphanium bromide | CAS Registry Number: 3607-17-8
Synonyms: 3-(Bromopropyl)triphenylphosphonium, NSC84074, CHEBI:383303, EINECS 222-770-9, Bromo(3-bromopropyl)triphenylphosphorus, CID2723862, (3-Bromopropyl)triphenylphosphonium bromide, Phosphonium, (3-bromopropyl)triphenyl- bromide

Molecular Formula: C21H21Br2PMolecular Weight: 464.173201 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ZAHUZZUGJRPGKW-UHFFFAOYSA-M


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