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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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• 4-Phenyl-2-Butanol
IUPAC Name: (2R)-4-phenylbutan-2-ol | CAS Registry Number: 2344-70-9
Synonyms: 4-Phenylbutan-2-ol, Methyl phenethyl carbinol, 558109_ALDRICH, (R)-(-)-4-Phenyl-2-butanol, CID641354, ZINC01850864, BENZENEPROPANOL, ALPHA-METHYL-, InChI=1/C10H14O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H

Molecular Formula: C10H14OMolecular Weight: 150.217560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: GDWRKZLROIFUML-SECBINFHSA-N

• 2'-Deoxyguanosine
IUPAC Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one | CAS Registry Number: 961-07-9
Synonyms: deoxyguanosine, Desoxyguanosine, 2'-deoxyguanosine, Guanine deoxyriboside, 2a8g, Guanine deoxy nucleoside, 2'-DEOXY-GUANOSINE, nchembio.2007.39-comp3, CHEBI:17172, AIDS000988, AIDS-000988, NSC22837, NSC 22837, SBB003059, ZINC00404256, NCGC00161975-01, ST066876, Guanosine, 2'-deoxy- (6CI,8CI,9CI), 9-(2-Deoxy-b-D-erythro-pentofuranosyl)guanine, C00330

Molecular Formula: C10H13N5O4Molecular Weight: 267.241320 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: YKBGVTZYEHREMT-KVQBGUIXSA-N

• 1,2,4,5-Tetrachlorobenzene
IUPAC Name: 1,2,4,5-tetrachlorobenzene | CAS Registry Number: 95-94-3
Synonyms: s-Tetrachlorobenzene, Benzene tetrachloride, Tetrachlorobenzene, 1,2,4,5-TETRACHLOROBENZENE, Benzene, tetrachloro-, Benzene, 1,2,4,5-tetrachloro-, RCRA waste no. U207, RCRA waste number U207, TETRACHLOROBENZENES, Maybridge1_002304, CCRIS 766, WLN: GR BG DG EG, 1,2,4,5-Tetrachlorbenzol, HSDB 2733, MLS001055490, DivK1c_001056, CID7270, 131857_ALDRICH, 34379_RIEDEL, 442219_SUPELCO

Molecular Formula: C6H2Cl4Molecular Weight: 215.892080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: JHBKHLUZVFWLAG-UHFFFAOYSA-N

• 1,4-Diiodobenzene
IUPAC Name: 1,4-diiodobenzene | CAS Registry Number: 624-38-4
Synonyms: p-Diiodobenzene, Benzene, p-diiodo-, p-Benzene diiodide, 1,4-DIIODOBENZENE, Benzene, 1,4-diiodo-, Benzene,1,4-diiodo-, Benzene, p-diiodo- (8CI), 193526_ALDRICH, NSC 6297, 37995_FLUKA, EINECS 210-842-2, NSC6297, AI3-08885, LS-184892, TL8004147, InChI=1/C6H4I2/c7-5-1-2-6(8)4-3-5/h1-4

Molecular Formula: C6H4I2Molecular Weight: 329.904900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: LFMWZTSOMGDDJU-UHFFFAOYSA-N

• 1,8-Octanedithiol
IUPAC Name: octane-1,8-dithiol | CAS Registry Number: 1191-62-4
Synonyms: 1,8-Dimercaptooctane, Octane-1,8-dithiol, 1,8-OCTANEDITHIOL, Octamethylene dimercaptan, 1,8-Octamethylenedithiol, NanoThinks(TM) THIO8, 1,8-Octanedithiol solution, FEMA No. 3514, O3605_ALDRICH, W351407_ALDRICH, 662615_ALDRICH, EINECS 214-738-8, BRN 1735431, CID14493, ZINC12358644, LS-2995, LT03378979, 4-01-00-02592 (Beilstein Handbook Reference)

Molecular Formula: C8H18S2Molecular Weight: 178.358520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: PGTWZHXOSWQKCY-UHFFFAOYSA-N

• (S)-Prolinol
IUPAC Name: [(2S)-pyrrolidin-2-yl]methanol | CAS Registry Number: 23356-96-9
Synonyms: L-Prolinol, Prolinol, 2-Pyrrolidinemethanol, pyrrolidin-2-ylmethanol, 186511_ALDRICH, ARK010, (S)-()-2-Pyrrolidinemethanol, CID640091, (S)-()-2-(Hydroxymethyl)pyrrolidine, TL8001937, InChI=1/C5H11NO/c7-4-5-2-1-3-6-5/h5-7H,1-4H, 498-63-5

Molecular Formula: C5H11NOMolecular Weight: 101.146940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: HVVNJUAVDAZWCB-YFKPBYRVSA-N

• (1-Propyl)triphenylphosphonium bromide
IUPAC Name: triphenyl(propyl)phosphanium bromide | CAS Registry Number: 6228-47-3
Synonyms: Triphenylpropylphosphonium bromide, CID80374, NSC50539, EINECS 228-330-2, Phosphonium, triphenylpropyl- bromide, ST5406604

Molecular Formula: C21H22BrPMolecular Weight: 385.277141 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: XMQSELBBYSAURN-UHFFFAOYSA-M

• 1-H 1,2,4-Ltriazole Sodium Salt
IUPAC Name: sodium 2,4-diaza-5-azanidacyclopenta-1,3-diene | CAS Registry Number: 41253-21-8
Synonyms: 1,2,4-Triazole sodium salt, Sodium-1,2-4-triazolide, Sodium 1H-1,2,4-triazolate, Sodium 1H-1,2,4-triazolide, 1,2,4-Triazole, sodium salt, MLS001335997, MLS001335998, 1,2,4-Triazole sodium derivative, 197645_ALDRICH, sodium 1,2,4-triazol-1-ide, 1H-1,2,4-Triazole, sodium salt, EINECS 255-280-9, NCGC00090960-01, SMR000857331, LS-195501, TL8006523, 1H-1,2,4-Triazole, sodium salt (1:1), 117547-14-5

Molecular Formula: C2H2N3NaMolecular Weight: 91.047150 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: NVMNEWNGLGACBB-UHFFFAOYSA-N

• 1-Aminocyclohexanecarboxylic Acid
IUPAC Name: 1-aminocyclohexane-1-carboxylic acid | CAS Registry Number: 2756-85-6
Synonyms: Homocycloleucine, 1-Aminocyclohexanecarboxylic acid, Lopac-A-162, Cyclohexanecarboxylic acid, 1-amino-, Lopac0_000117, 1-Aminocyclohexane-1-carboxylic acid, 218693_ALDRICH, NSC 9059, alpha-Aminocyclohexanecarboxylic acid, alpha-Aminocyclohexanecarboxylic aicd, EINECS 220-411-0, CID1366, NSC9059, .alpha.-Aminocyclohexanecarboxylic acid, CB 1641, BRN 2355692, .alpha.-Aminocyclohexanecarboxylic aicd, NCGC00015011-01, NCGC00162066-01, LS-56603

Molecular Formula: C7H13NO2Molecular Weight: 143.183620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WOXWUZCRWJWTRT-UHFFFAOYSA-N

• 2'-Hydroxy-2,4,4',5,6'-Pentamethoxychalcone
IUPAC Name: (E)-1-(2-hydroxy-4,6-dimethoxyphenyl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one | CAS Registry Number: 73694-15-2
Synonyms: Rubone, ST083652, 2'-HYDROXY-2,4,4',5,6'-PENTAMETHOXYCHALCONE, AG-G-91789, ZINC04104685, AC1NZ6DK, SureCN4446404, LMPK12120286, FT-0612526, I14-111056, (2E)-1-(2-hydroxy-4,6-dimethoxyphenyl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-o ne, (E)-1-(2-hydroxy-4,6-dimethoxyphenyl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one

Molecular Formula: C20H22O7Molecular Weight: 374.384480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: VHCQVGQULWFQTM-VOTSOKGWSA-N

• (S)-(-)-N-(3-Pentyl)-1-Phenylethylamine Hydrochloride
IUPAC Name: N-(1-phenylethyl)pentan-3-amine;hydrochloride | CAS Registry Number: 374790-92-8
Synonyms: 374790-91-7, ACMC-20apho, ACMC-20apic, (R)-(+)-N-(3-Pentyl)-1-phenylethylamine hydrochloride, (S)-(-)-N-(3-Pentyl)-1-phenylethylamine hydrochloride, (R)-N-(3-Pentyl)-1-Phenylethylamine Hydrochloride

Molecular Formula: C13H22ClNMolecular Weight: 227.773480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: RKPRPVRHVBFULB-UHFFFAOYSA-N

• 1-Benzyl-1,2,3-triazole-4,5-dicarboxylic acid
IUPAC Name: 1-(phenylmethyl)triazole-4,5-dicarboxylic acid | CAS Registry Number: 73953-89-6
Synonyms: Oprea1_261084, BRN 0029417, SBB008182, v-Triazole-4,5-dicarboxylic acid, 1-benzyl-, FR-1023, BAS 04832938, LS-155919, UNM000011079001, 4-26-00-00965 (Beilstein Handbook Reference), SR-01000393655-2, 1-Benzyl-1H-[1,2,3]triazole-4,5-dicarboxylic acid, 1H-1,2,3-Triazole-4,5-dicarboxylic acid, 1-(phenylmethyl)-

Molecular Formula: C11H9N3O4Molecular Weight: 247.206860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: IYYBUXUZYWGZGB-UHFFFAOYSA-N

• (±)-6-Methyl-5-hepten-2-ol
IUPAC Name: 6-methylhept-5-en-2-ol | CAS Registry Number: 1569-60-4
Synonyms: Sulcatol, 6-METHYL-5-HEPTEN-2-OL, 6-Methylhept-5-en-2-ol, 5-Hepten-2-ol, 6-methyl-, 2-Methyl-2-hepten-6-ol, dl-6-Methyl-5-hepten-2-ol, W511404_ALDRICH, 195871_ALDRICH, 6-Hydroxy-2-methyl-2-heptene, CID20745, CHEBI:15833, CPD-8169, NSC66273, EINECS 216-377-1, NSC 66273, SBB008067, FR-0834, AI3-25074, C07288, 4630-06-2

Molecular Formula: C8H16OMolecular Weight: 128.212040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: OHEFFKYYKJVVOX-UHFFFAOYSA-N

• 1,2,4-Triazolo[4,3-A]Quinoline
IUPAC Name: [1,2,4]triazolo[4,3-a]quinoline | CAS Registry Number: 235-06-3
Synonyms: s-Triazolo(4,3-a)quinoline, 2,3,9b-Triazabenz[e]indene, EINECS 205-943-3, (1,2,4)Triazolo(4,3-a)quinoline, [1,2,4]Triazolo[4,3-a]quinoline, TRIAZOLO (4,3A)QUINOLINE, ZINC00088958, AI3-52871, LS-156869, A2561/0109094, InChI=1/C10H7N3/c1-2-4-9-8(3-1)5-6-10-12-11-7-13(9)10/h1-7

Molecular Formula: C10H7N3Molecular Weight: 169.182680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: PIRYKGLQLCKQPG-UHFFFAOYSA-N

• 3-Chloro-2-Hydroxy-Propyl Trimethyl Ammonium Chloride
IUPAC Name: (3-chloro-2-hydroxypropyl)-trimethylazanium chloride | CAS Registry Number: 3327-22-8
Synonyms: Dextrosil, Catiomaster C, Dextrosil KA, Verolan KAF, Dowquat 188, QUAB, Quat 188, 348287_ALDRICH, NT 21, 24888_FLUKA, EINECS 222-048-3, NSC 51216, 3-Chloro-2-hydroxypropylammonium chloride, NSC51216, 2-Hydroxy-3-chloropropyltrimethylammonium chloride, LS-17180, (3-Chloro-2-hydroxypropyl)trimethylammonium chloride, Trimethyl(2-hydroxy-3-chloropropyl)ammonium chloride, 1-Propanaminium, 3-chloro-2-hydroxy-N,N,N-trimethyl-, chloride, AMMONIUM, (3-CHLORO-2-HYDROXYPROPYL)TRIMETHYL-, CHLORIDE

Molecular Formula: C6H15Cl2NOMolecular Weight: 188.095400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CSPHGSFZFWKVDL-UHFFFAOYSA-M

• (R)-(-)-1,1'-Bi(2-naphthol),[(R)-BINOL]
IUPAC Name: 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol | CAS Registry Number: 18531-94-7
Synonyms: 1,1'-Bi-2-naphthol, (S)-(-)-1,1'-Bi-2-naphthol, 18531-99-2, 602-09-5, 2,2'-Dinaphthol, binol, (R)-(+)-1,1'-Bi-2-naphthol, beta-Binaphthol, 1,1'-Binaphthyl-2,2'-diol, (S)-BINOL, (R)-1,1'-Bi-2-naphthol, 1,1'-Bis-2-naphthol, 2,2'-Dihydroxydinaphthyl, Chiral binaphthol, 2,2'-Dihydroxy-1,1'-binaphthyl, 2,2'-Dihydroxy-1,1'-dinaphthyl, Bis-beta-naphthol, 2,2'-Dihydroxybinaphthalene, s-(-)-1,1'-bi-2-naphthol, [1,1'-Binaphthalene]-2,2'-diol

Molecular Formula: C20H14O2Molecular Weight: 286.323960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: PPTXVXKCQZKFBN-UHFFFAOYSA-N

• (1,5-Cyclooctadiene)(Pyridine)(Tricyclohexylphosphine)Iridium(I) Hexafluorophosphate
IUPAC Name: cycloocta-1,5-diene; iridium; pyridine; tricyclohexylphosphane; hexafluorophosphate | CAS Registry Number: 64536-78-3
Synonyms: CID2734563, CID 5702647, TRICYCLOHEXYLPHOSPHINE-(1,5-CYCLOOCTADIENE)-(PYRIDINE) IRIDIUM (I) HEXAFLUOROPHOSPHATE

Molecular Formula: C31H50F6IrNP2-Molecular Weight: 804.890341 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 8

InChIKey: WLRQNTYCIFESRH-UHFFFAOYSA-N

• 1-Hydroxymethyl-5,5-Dimethylhydantoin
IUPAC Name: 1-(hydroxymethyl)-5,5-dimethylimidazolidine-2,4-dione | CAS Registry Number: 116-25-6
Synonyms: MDM Hydantoin, GlycoServe, MDMH, MDM Hydantoin (VAN), Monomethylol dimethyl hydantoin, Mono-methyloldimethylhydantoin, NSC 9185, EINECS 204-132-1, NSC9185, 1-Monomethylol-5,5-dimethylhydantoin, 1-(Hydroxymethyl)-5,5-dimethylhydantoin, 1-Hydroxymethyl-5,5-dimethylhydantoin, EPA Pesticide Chemical Code 121301, CID67000, Hydroxymethyl-5,5-dimethylhydantoin, ZINC00156245, Hydantoin, 1-(hydroxymethyl)-5,5-dimethyl-, 1-(Hydroxymethyl)-5,5-dimethyl hydantoin, NCGC00164225-01, LS-79198

Molecular Formula: C6H10N2O3Molecular Weight: 158.155200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SIQZJFKTROUNPI-UHFFFAOYSA-N

• 1,2-Naphthoquinone-4-Sulfonic Acid, Sodium Salt
IUPAC Name: sodium 3,4-dioxonaphthalene-1-sulfonate | CAS Registry Number: 521-24-4
Synonyms: Folin's reagent, N1766_SIGMA, 226017_ALDRICH, Sodium 1,2-naphthoquinone-4-sulfonate, EINECS 208-308-9, Sodium beta-naphthoquinone-4-sulfonate, Sodium 3,4-dioxonaphthalene-1-sulphonate, AI3-50008, beta-Naphthoquinone-4-sulfonate sodium salt, LS-94917, ST5411433, 1,2-Naphthoquinone-4-sulfonic acid sodium salt, 1,2-Naphthoquinone-4-sulfonic acid, sodium salt, Sodium 3,4-dihydro-3,4-dioxo-1-naphthalenesulfonate, 1-NAPHTHALENESULFONIC ACID, 3,4-DIHYDRO-3,4-DIOXO-, SODIUM SALT, 3,4-Dihydro-3,4-dioxo-1-naphthalenesulfonic acid sodium salt, 2066-93-5

Molecular Formula: C10H5NaO5SMolecular Weight: 260.198470 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: UBLXEEBHYISRFM-UHFFFAOYSA-M

• 1-Phenylnaphthalene
IUPAC Name: 1-phenylnaphthalene | CAS Registry Number: 605-02-7
Synonyms: 1-PHENYLNAPHTHALENE, Naphthalene, 1-phenyl-, P27402_ALDRICH, NSC5257, NSC 5257, EINECS 210-081-6, Naphthalene, 1-phenyl- (8CI)(9CI), ST5406166, InChI=1/C16H12/c1-2-7-13(8-3-1)16-12-6-10-14-9-4-5-11-15(14)16/h1-12

Molecular Formula: C16H12Molecular Weight: 204.266480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: IYDMICQAKLQHLA-UHFFFAOYSA-N

• 11-Hexadecyn-1-Ol
IUPAC Name: hexadec-11-yn-1-ol | CAS Registry Number: 65686-49-9
Synonyms: 11-Hexadecyn-1-ol, ZINC02555306, CID144130

Molecular Formula: C16H30OMolecular Weight: 238.408800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: CWJKFTYJCIEEDB-UHFFFAOYSA-N

• 1,4-Dibromo-2,5-dimethoxybenzene
IUPAC Name: 1,4-dibromo-2,5-dimethoxybenzene | CAS Registry Number: 2674-34-2
Synonyms: Maybridge1_005131, 461105_ALDRICH, NSC27013, ZINC00057059, ST5307780, InChI=1/C8H8Br2O2/c1-11-7-3-6(10)8(12-2)4-5(7)9/h3-4H,1-2H

Molecular Formula: C8H8Br2O2Molecular Weight: 295.955920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: CHCLRVOURKGRSW-UHFFFAOYSA-N

• 2,2-Difluoro-5-formylbenzodioxole
IUPAC Name: 2,2-difluoro-1,3-benzodioxole-5-carbaldehyde | CAS Registry Number: 656-42-8
Synonyms: 594423_ALDRICH, ZINC02569259, CID2736973, 2,2-Difluoro-1,3-benzodioxole-5-carboxaldehyde

Molecular Formula: C8H4F2O3Molecular Weight: 186.112366 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: GGERGLKEDUUSAP-UHFFFAOYSA-N

• (S)-(-)-1,1'-Bi(2-naphthyl)-2,2-diyl hydrogen phosphate [(S)-BNP Acid]
Synonyms: 1,1'-Binaphthyl-2,2'-diyl hydrogenphosphate, 35193-63-6, 39648-67-4, (R)-(-)-1,1'-Binaphthyl-2,2'-diyl hydrogenphosphate, (S)-(+)-1,1'-Binaphthyl-2,2'-diyl hydrogenphosphate, (R)-(-)-1,1'-Binaphthyl-2,2'-diyl hydrogen phosphate, SBB058107, (R)-(-)-2,2'-Dihydroxy-1,1'-binaphthyl Hydrogen Phosphate, (S)-(+)-2,2'-Dihydroxy-1,1'-binaphthyl Hydrogen Phosphate, dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-ol 4-oxide, (+/-)-1,1'-Binaphthyl-2,2'-diyl Hydrogenphosphate, (+/-)-2,2'-Dihydroxy-1,1'-binaphthyl Hydrogenphosphate, (R)-(-)-1,1'-Binaphthalene-2,2'-diyl hydrogen phosphate, (S)-(+)-1,1'-Binaphthalene-2,2'-diyl hydrogen phosphate, (R)-4-Hydroxydinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-oxide, (S)-4-Hydroxydinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-oxide, 248932_ALDRICH, 4-hydroxynaphtho[1,2-f]naphtho[2,1-d]1,3,2-dioxaphosphepin-4-one, BNDHP, BNPA

Molecular Formula: C20H13O4PMolecular Weight: 348.288582 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JEHUZVBIUCAMRZ-UHFFFAOYSA-N

• 1-Iodo-4-Nitrobenzene
IUPAC Name: 1-iodo-4-nitrobenzene | CAS Registry Number: 636-98-6
Synonyms: p-Iodonitrobenzene, 1-Iodo-4-nitrobenzene, p-Nitroiodobenzene, 4-Nitroiodobenzene, p-Nitrophenyl iodide, Benzene, 1-iodo-4-nitro-, 4-IODONITROBENZENE, I9805_ALDRICH, ghl.PD_Mitscher_leg0.938, NSC9794, NSC 9794, EINECS 211-272-7, STK335825, ZINC01511626, AI3-08878, TL8004462, InChI=1/C6H4INO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4

Molecular Formula: C6H4INO2Molecular Weight: 249.005930 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SCCCFNJTCDSLCY-UHFFFAOYSA-N

• 1,2-Diiodoethane
IUPAC Name: 1,2-diiodoethane | CAS Registry Number: 624-73-7
Synonyms: Diiodoethane, Ethylene iodide, Ethylene diiodide, Ethane, 1,2-diiodo-, 1,2-DIIODOETHANE, D122807_ALDRICH, CID12224, EINECS 210-859-5, OR2622, TL8004160, InChI=1/C2H4I2/c3-1-2-4/h1-2H

Molecular Formula: C2H4I2Molecular Weight: 281.862100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: GBBZLMLLFVFKJM-UHFFFAOYSA-N

• 1-(2-Furyl)-2-Nitroethylene
IUPAC Name: 2-[(E)-2-nitroethenyl]furan | CAS Registry Number: 699-18-3
Synonyms: 2-(2-Nitrovinyl)furan, 2-Furylnitroethylene, beta-Nitrovinylfuran, .beta.-Nitrovinylfuran, HeVLAHAFbTyImYQeiiiAFP, 1-(2-Furyl)-2-nitroethylene, WLN: T5OJ B1U1NW, trans-2-(2-nitrovinyl)furan, (E)-2-(2-nitrovinyl)furan, NSC5650, Furan, 2-(2-nitroethenyl)-, 478717_ALDRICH, CCRIS 5662, Ethylene, 1-(2-furyl)-2-nitro-, ZERO/008042, FURAN, 2-(2-NITROVINYL)-, 1-(alpha-Furyl)-2-nitroethylene, CHEBI:476617, NSC 5650, 1-(.alpha.-Furyl)-2-nitroethylene

Molecular Formula: C6H5NO3Molecular Weight: 139.108800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WVUICGOYGDHVBH-ONEGZZNKSA-N

• 1,3,5-Tribromobenzene
IUPAC Name: 1,3,5-tribromobenzene | CAS Registry Number: 626-39-1
Synonyms: 1,3,5-TRIBROMOBENZENE, Benzene, 1,3,5-tribromo-, NCIOpen2_008123, 140066_ALDRICH, NSC62439, 90715_FLUKA, EINECS 210-947-3, NSC 62439, CID12279, AI3-15483, LS-32209, TL806114, ST5406609, InChI=1/C6H3Br3/c7-4-1-5(8)3-6(9)2-4/h1-3

Molecular Formula: C6H3Br3Molecular Weight: 314.800020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: YWDUZLFWHVQCHY-UHFFFAOYSA-N

• 1-bromo-2,3,5,6-Tetramethylbenzene
IUPAC Name: 3-bromo-1,2,4,5-tetramethylbenzene | CAS Registry Number: 1646-53-3
Synonyms: Bromodurene, 3-Bromodurene, 250104_ALDRICH, 1-Bromo-2,3,5,6-tetramethylbenzene, 3-Bromo-1,2,4,5-tetramethylbenzene, Benzene, 3-bromo-1,2,4,5-tetramethyl-, NSC87881, EINECS 216-707-4, SBB008221, ZINC01995246, FR-1079, AB-131/40897155, InChI=1/C10H13Br/c1-6-5-7(2)9(4)10(11)8(6)3/h5H,1-4H

Molecular Formula: C10H13BrMolecular Weight: 213.114220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: WJKBPTLQJXKEHC-UHFFFAOYSA-N

• 1-Bromo-6-phenylhexane
IUPAC Name: 6-bromohexylbenzene | CAS Registry Number: 27976-27-8
Synonyms: 1-Bromo-6-phenyl-hexane, Hexane, 1-bromo-6-phenyl-, Benzene, (6-bromohexyl)-, CID561788

Molecular Formula: C12H17BrMolecular Weight: 241.167380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: RAOLIGFNQJMMKW-UHFFFAOYSA-N

• 1,6-Hexanediol
IUPAC Name: hexane-1,6-diol | CAS Registry Number: 629-11-8
Synonyms: Hexamethylene glycol, Hexamethylenediol, 1,6-HEXANEDIOL, Hexane-1,6-diol, 1,6-Dihydroxyhexane, .omega.-Hexanediol, alpha,omega-Hexanediol, 1,6-Hexanediol solution, .alpha.,.omega.-Hexanediol, WLN: Q6Q, CCRIS 8982, H11807_ALDRICH, HSDB 6488, NSC 508, 240117_ALDRICH, NSC508, 88571_FLUKA, EINECS 211-074-0, BRN 1633461, ZINC01555566

Molecular Formula: C6H14O2Molecular Weight: 118.174160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: XXMIOPMDWAUFGU-UHFFFAOYSA-N

• (S)-(+)-2,2-Bis(diphenylphosphino)-1,1-binaphthyl [(S)-BINAP]
IUPAC Name: [1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane | CAS Registry Number: 76189-56-5
Synonyms: 76189-55-4, (R)-(+)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, 98327-87-8, 2,2'-BIS(DIPHENYLPHOSPHINO)-1,1'-BINAPHTHYL, (R)-(+)-BINAP, (S)-(-)-BINAP, (+/-)-BINAP, rac-BINAP, BINAP, (S)-(-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, (+/-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, (S)-BINAP, (R)-2,2'-bis(Diphenylphosphino)-1,1'-binaphthyl, (S)-(+)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, (S)-(-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthalene, (S)-(-)-2,2'-Bis(diphenylphosphosino)-1,1'-binaphthyl, 2,2'-Bis(diphenylphosphino)-1,1'-binaphthalene, 2,2'-Bis-diphenylphosphanyl-[1,1']binaphthalenyl, (+/-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthalene, (R)-(+)-2,2'-Bis(diphenylphosphino)-1'1-binaphthyl

Molecular Formula: C44H32P2Molecular Weight: 622.672404 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: MUALRAIOVNYAIW-UHFFFAOYSA-N

• (1s,2s)-(-)-3-Exo-Hydroxy-2,10-Camphorsultam
Synonyms: ZINC86860364, FT-0604561, (1S,2S)-(-)-3-EXO-HYDROXY-2,10-CAMPHORSULTAM

Molecular Formula: C10H17NO3SMolecular Weight: 231.310 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: DUTRUIRCGZNESY-OORONAJNSA-N

• 1-Iodo-4,4,4-Trifluorobutane
IUPAC Name: 1,1,1-trifluoro-4-iodobutane | CAS Registry Number: 461-17-6
Synonyms: 1,1,1-Trifluoro-4-iodobutane, FS000322, 3S210882

Molecular Formula: C4H6F3IMolecular Weight: 237.990120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: LNDGACQEAYKNOI-UHFFFAOYSA-N

• 2,3,3-Trimethyl-4-5-benzo-3H-indole
IUPAC Name: 1,1,2-trimethylbenzo[e]indole | CAS Registry Number: 41532-84-7
Synonyms: MLS001018037, 1,1,2-Trimethylbenz[e]indole, 03024_FLUKA, ZINC01042104, EINECS 255-429-8, 1,1,2-Trimethyl-1H-benz(e)indole, 1,1-2-Trimethyl-1H-benz(e)indole, CID170530, 1H-Benz(e)indole, 1,1,2-trimethyl-, SMR000354277, ST5135389, EU-0010594, T-6620, SR-01000389684-2

Molecular Formula: C15H15NMolecular Weight: 209.286300 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: WJZSZXCWMATYFX-UHFFFAOYSA-N

• 12-Hydroxy Stearic Acid
IUPAC Name: 12-hydroxyoctadecanoic acid | CAS Registry Number: 106-14-9
Synonyms: Harwax A, 12-Hydroxystearic acid, Ceroxin GL, Barolub FTO, Cerit Fac 3, Hydroxystearic acid, Hydrofol acid 200, Loxiol G 21, Octadecanoic acid, 12-hydroxy-, Stearic acid, 12-hydroxy-, DL-12-Hydroxystearic acid, 12-HYDROXYOCTADECANOIC ACID, DL-12-hydroxy stearic acid, WLN: QV10YQ6, 12-hydroxy-octadecanoic acid, HSDB 5368, 219967_ALDRICH, 12-Hydroxystearic acid estolide, NSC 2385, 56440_FLUKA

Molecular Formula: C18H36O3Molecular Weight: 300.476640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: ULQISTXYYBZJSJ-UHFFFAOYSA-N

• 1-Isoquinolinyl Phenyl Ketone
IUPAC Name: isoquinolin-1-yl(phenyl)methanone | CAS Registry Number: 16576-23-1
Synonyms: Enamine_001931, Oprea1_449028, Oprea1_473081, 1-Isoquinolinyl phenyl ketone, MLS000388644, 357960_ALDRICH, isoquinolin-1-yl(phenyl)methanone, NSC131470, CID280081, ZINC00332894, SMR000254817, AF-399/25108062, T5466258

Molecular Formula: C16H11NOMolecular Weight: 233.264640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MDWCIKACMBMJFA-UHFFFAOYSA-N

• 1-Carbethoxyethyl triphenylphosphonium bromide
IUPAC Name: (1-ethoxy-1-oxopropan-2-yl)-triphenylphosphanium bromide | CAS Registry Number: 30018-16-7
Synonyms: EINECS 250-002-2, CID3084511, ST5408557, (2-Ethoxy-1-methyl-2-oxoethyl)triphenylphosphonium bromide

Molecular Formula: C23H24BrO2PMolecular Weight: 443.313221 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: RSYXORMKBUFAMS-UHFFFAOYSA-M

• 1,2,4-Triazolo[4,3-a]pyridin-3(2H)-one
IUPAC Name: 2H-[1,2,4]triazolo[4,3-a]pyridin-3-one | CAS Registry Number: 6969-71-7
Synonyms: s-Triazolo[4,3-a]pyridin-3-ol, 3-Hydroxytriazolo[4,3-a]pyridine, NSC68462, EINECS 230-191-8, ZINC00063776, ZINC02654018, [1,2,4]Triazolo[4,3-a]pyridin-3(2H)-one, TL8004899, 1,2,4-Triazolo(4,3-a)pyridin-3(2H)-one, T5245627

Molecular Formula: C6H5N3OMolecular Weight: 135.123400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LJRXNXBFJXXRNQ-UHFFFAOYSA-N

• 1-Bromo-2,3,5-trifluorobenzene
IUPAC Name: 1-bromo-2,3,5-trifluorobenzene | CAS Registry Number: 133739-70-5
Synonyms: JRD-0417, ST5408597, TL8000802, InChI=1/C6H2BrF3/c7-4-1-3(8)2-5(9)6(4)10/h1-2

Molecular Formula: C6H2BrF3Molecular Weight: 210.979290 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XSMLLZPSNLQCQU-UHFFFAOYSA-N

• 1,3-Diphenylisobenzofuran
IUPAC Name: 1,3-di(phenyl)-2-benzofuran | CAS Registry Number: 5471-63-6
Synonyms: Diphenylisobenzofuran, 1,3 Diphenylisobenzofuran, 1,3-Diphenyl-2-benzofuran, 1,3-DIPHENYLISOBENZOFURAN, 105481_ALDRICH, 2,5-Diphenyl-3,4-benzofuran, 43092_FLUKA, CID21649, NSC28407, EINECS 226-808-5, NSC 28407, ZINC01037072, ST5308066, InChI=1/C20H14O/c1-3-9-15(10-4-1)19-17-13-7-8-14-18(17)20(21-19)16-11-5-2-6-12-16/h1-14

Molecular Formula: C20H14OMolecular Weight: 270.324560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ZKSVYBRJSMBDMV-UHFFFAOYSA-N

• 1,2-Benzodiphenylene sulfide
IUPAC Name: naphtho[1,2-b][1]benzothiole | CAS Registry Number: 239-35-0
Synonyms: Benzo[a]dibenzothiophene, Benzo(a)dibenzothiophene, 1,2-Benzo-9-thiafluorene, 11-Thiabenzo(a)fluorene, Benzo[b]naphtho[2,1-d]thiophene, Naphtho(1,2-b)thianaphthene, CCRIS 4012, Naphtho[1,2-b]thianaphthene, 255122_ALDRICH, EINECS 205-948-0, CID9198, NSC 89259, NSC89259, BENZO(B)NAPHTHO(2,1-D)THIOPHENE, Benzo(b)naphtho(2,1-d)thiophene (8CI), LS-188115, Benzo(b)naphtho(2,1-d)thiophene (8CI)(9CI)

Molecular Formula: C16H10SMolecular Weight: 234.315600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: YEUHHUCOSQOCIX-UHFFFAOYSA-N

• 1-(P-Tolyl)Piperazine Dihydrochloride
IUPAC Name: 1-(4-methylphenyl)piperazine dihydrochloride | CAS Registry Number: 13078-14-3
Synonyms: 1-(p-Tolyl)piperazine HCl, 1-(p-Tolyl)piperazine dihydrochloride, CID83112, 1-(p-TOLYL)PIPERAZINE di HCl, EINECS 235-975-3, LT00455220

Molecular Formula: C11H18Cl2N2Molecular Weight: 249.180020 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: PMGFOTNCJZITIM-UHFFFAOYSA-N

• 1-Heptane Sulphonic Acid Sodium Salt
IUPAC Name: sodium heptane-1-sulfonate | CAS Registry Number: 22767-50-6
Synonyms: Sodium heptane-1-sulphonate, SODIUM HEPTANE SULFONATE, 51832_FLUKA, 51833_FLUKA, 51835_FLUKA, CID89828, 1-Heptanesulfonic acid, sodium salt, EINECS 245-210-5, Sodium 1-heptanesulfonate monohydrate, 1-Heptanesulfonic acid sodium salt monohydrate

Molecular Formula: C7H15NaO3SMolecular Weight: 202.246970 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: REFMEZARFCPESH-UHFFFAOYSA-M

• 1,2-O-Isopropylidene-alpha-D-glucofuranose
IUPAC Name: 1-(6-hydroxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl)ethane-1,2-diol | CAS Registry Number: 18549-40-1
Synonyms: Maybridge3_000378, Oprea1_758719, CBDivE_002426, 1,2-O-Isopropylidene-D-glucofuranose, NSC1697, IDI1_011765, ST5039974, .alpha.-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, Glucofuranose, 1,2-O-isopropylidene-, .alpha.-D-

Molecular Formula: C9H16O6Molecular Weight: 220.219740 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: BGGCXQKYCBBHAH-UHFFFAOYSA-N

• 1-(2-Chloroethyl)-4-fluorobenzene
IUPAC Name: 1-(2-chloroethyl)-4-fluorobenzene | CAS Registry Number: 332-43-4
Synonyms: EINECS 206-364-9, CID67622

Molecular Formula: C8H8ClFMolecular Weight: 158.600523 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LPUURRVXQCVXCX-UHFFFAOYSA-N

• 1,4-Dihydroxy Anthraquinone
IUPAC Name: 1,4-dihydroxyanthracene-9,10-dione | CAS Registry Number: 81-64-1
Synonyms: Quinizarin, Chinizarin, Quinizarine, Smoke Orange R, 1,4-Dihydroxyanthraquinone, Macrolex Orange GG, Solvent Orange 86, 1,4-Doa [Russian], Anthraquinone, 1,4-dihydroxy-, 1,4-Dihydroxyanthrachinon, 1,4-Dioxyanthraquinone, 1,4-Dihydroxy-9,10-anthraquinone, Q906_ALDRICH, 1,4-Doa, CCRIS 3524, 9,10-Anthracenedione, 1,4-dihydroxy-, HSDB 5242, 1,4-Dioxyanthraquinone [Russian], MEGxp0_001867, 1,4-Dihydroxyanthrachinon [Czech]

Molecular Formula: C14H8O4Molecular Weight: 240.210920 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GUEIZVNYDFNHJU-UHFFFAOYSA-N

• (±)-2-Hydroxy-2-phenylpropionic acid hemihydrate
IUPAC Name: 2-hydroxy-2-phenylpropanoic acid | CAS Registry Number: 515-30-0
Synonyms: Atrolactic acid, 2-Phenyllactic acid, DL-Atrolactic acid, alpha-Methylmandelic acid, 2-Hydroxy-2-phenylpropanoic acid, Maybridge3_003173, .alpha.-Phenyllactic acid, Mandelic acid, .alpha.-methyl-, (1)-2-Phenyllactic acid, DL-.alpha.-Phenyllactic acid, DL-alpha-Phenyllactic acid, 2-Hydroxy-2-phenylpropionic acid, Oprea1_696321, 2-Phenyl-2-hydroxypropionic acid, CHEBI:50392, alpha-Hydroxy-alpha-phenylpropionic acid, EINECS 208-196-1, EINECS 225-014-6, NSC128998, NSC152653

Molecular Formula: C9H10O3Molecular Weight: 166.173900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: NWCHELUCVWSRRS-UHFFFAOYSA-N

• (3s,7ar)-3-T-Butyl-7a-Methyl Bicyclic Lactam
IUPAC Name: (3S,7aR)-7a-methyl-3-propan-2-yl-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]oxazol-5-one | CAS Registry Number: 98203-44-2
Synonyms: CID853157, NSC644299, ZINC00389570

Molecular Formula: C10H17NO2Molecular Weight: 183.247480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NUUDVADIQSLTCN-PSASIEDQSA-N

• 2-iodo-1,4-dimethylbenzene
IUPAC Name: 2-iodo-1,4-dimethylbenzene | CAS Registry Number: 1122-42-5
Synonyms: p-Xylene, 2-iodo-, 2-Iodo-p-xylene, Ambap1771, Benzene, 2-iodo-1,4-dimethyl-, 1-Iodo-2,5-dimethylbenzene, 2-Iodo-1,4-dimethylbenzene, NSC3779, p-Xylene, 2-iodo- (8CI), CID70731, NSC 3779, EINECS 214-347-2

Molecular Formula: C8H9IMolecular Weight: 232.061530 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: WYZVNUSNUCABRF-UHFFFAOYSA-N


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