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Advanced Synthesis Technologies, S. A.

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Profile: Advanced Synthesis Technologies, S. A provides organic chemicals, pharmaceuticals intermediates, toll processing, distillation and combination chemistry. Our products include 2-acetylbenzoic acid, amyl valerate, 2-ethoxy-3-methylpyrazine and 4-methyl valeric acid. We offer 2-nonenoic acid, norbornene epoxide, 2-pyridylacetonitrile, triethylsilanol and vinyl magnesium bromide products.

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• 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluoro-10-Iododecane
IUPAC Name: 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-10-iododecane | CAS Registry Number: 2043-53-0
Synonyms: 370525_ALDRICH, 80219_FLUKA, EINECS 218-053-5, 1-Iodo-1H,1H,2H,2H-perfluorodecane, CID74885, 1H,1H,2H,2H-Perfluorodecyl iodide, 1H,1H,2H,2H-Perfluoro-1-decyl iodide, Alkyl iodides, C10-12, gamma-omega-perfluoro, 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluoro-10-iododecane, Decane, 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-10-iodo-, 68390-33-0

Molecular Formula: C10H4F17IMolecular Weight: 574.016084 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 17

InChIKey: XVKJSLBVVRCOIT-UHFFFAOYSA-N

• 2,5-Hexanediol
IUPAC Name: hexane-2,5-diol | CAS Registry Number: 2935-44-6
Synonyms: Diisopropanol, 2,5-HEXANEDIOL, 2,5-Dihydroxyhexane, 2,4-Hexanediol, 2,5-Hexylene glycol, 2,5-Hexanediol solution, H11904_ALDRICH, WLN: QY1&2YQ1, 2,5-Hexanediol 3 M solution, NSC 3699, 50788_FLUKA, 50788_SIGMA, EINECS 220-910-3, NSC3699, CID18049, BRN 1719248, ZINC00388715, AI3-07556, LS-75085, 4-01-00-02562 (Beilstein Handbook Reference)

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

InChIKey: OHMBHFSEKCCCBW-UHFFFAOYSA-N

• 1-Benzyl-2-Pyrrolidinone
IUPAC Name: 1-benzylpyrrolidin-2-one | CAS Registry Number: 5291-77-0
Synonyms: 1-benzylpyrrolidin-2-one, 1-Benzyl-2-pyrrolidinone, 1-Benzyl-2-pyrrolidone, 1-Benzyl-3-pyrrolidone, N-Benzylpyrrolidin-2-one, MLS001074862, Maleimide-Related Compound 15, 123757_ALDRICH, NSC30184, 2-Pyrrolidinone, 1-(phenylmethyl)-, CHEBI:474868, CID79176, EINECS 226-131-5, ZINC00388147, SMR000568394, LT03381432, InChI=1/C11H13NO/c13-11-7-4-8-12(11)9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H

Molecular Formula: C11H13NOMolecular Weight: 175.227020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LVUQCTGSDJLWCE-UHFFFAOYSA-N

• 1,4-Dioxane
IUPAC Name: 1,4-dioxane | CAS Registry Number: 123-91-1
Synonyms: p-Dioxane, Dioxane, Dioxan, Diethylene ether, 1,4-DIOXANE, Diethylene oxide, Diokan, Di(ethylene oxide), Tetrahydro-p-dioxin, Diethylene dioxide, para-Dioxane, Dioxyethylene ether, 1,4-Diethylene dioxide, Dioxane-1,4, Dioxanne, Glycolethylenether, Dioksan, Glycol ethylene ether, Diox, :dioxane

Molecular Formula: C4H8O2Molecular Weight: 88.105120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RYHBNJHYFVUHQT-UHFFFAOYSA-N

• 1,2,3-Trimethoxy Benzene
IUPAC Name: 1,2,3-trimethoxybenzene | CAS Registry Number: 634-36-6
Synonyms: Methylsyringol, Tri-O-methylpyrogallol, Pyrogallol trimethyl ether, 1,2,3-TRIMETHOXYBENZENE, Methylsyringol (VAN), Benzene, 1,2,3-trimethoxy-, 137995_ALDRICH, 92159_FLUKA, CID12462, NSC10124, EINECS 211-207-2, NSC 10124, ZINC00152503, AI3-02077, ST5406631, TL8004419

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

InChIKey: CRUILBNAQILVHZ-UHFFFAOYSA-N

• 1,2-Dibromoethane
IUPAC Name: 1,2-dibromoethane | CAS Registry Number: 106-93-4
Synonyms: Ethylene bromide, sym-Dibromoethane, Aadibroom, Bromofume, Sanhyuum, Soilbrom, Soilfume, Celmide, Edabrom, Kopfume, Unifume, Nephis, Nefis, ETHYLENE DIBROMIDE, Glycol Dibromide, Iscobrome D, Fumo-gas, Dibromoethylene, Pestmaster, dibromoet hane

Molecular Formula: C2H4Br2Molecular Weight: 187.861160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: PAAZPARNPHGIKF-UHFFFAOYSA-N

• 1,3-Dimethylbenzene
IUPAC Name: 1,3-dimethylbenzene | CAS Registry Number: 108-38-3
Synonyms: M-XYLENE, m-Xylol, m-Dimethylbenzene, m-Methyltoluene, meta-Xylene, 1,3-Xylene, 3-Xylene, Dimethylbenzene, Benzene, 1,3-dimethyl-, Xylol, m-Xylenes, Xylene, m-, Santosol 150, Xylene, m-isomer, m-Xylene, benzylated, Benzene, dimethyl-, Benzene, m-dimethyl-, 1,3-Dimethylbenzol, XYLENES, Xylene, mixed isomers

Molecular Formula: C8H10Molecular Weight: 106.165000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: IVSZLXZYQVIEFR-UHFFFAOYSA-N

• 1-Naphthol
IUPAC Name: naphthalen-1-ol | CAS Registry Number: 90-15-3
Synonyms: 1-NAPHTHOL, alpha-naphthol, 1-Naphthalenol, naphthalen-1-ol, Fouramine ERN, Fourrine ERN, Tertral ERN, Furro ER, Basf Ursol ERN, 1-Hydroxynaphthalene, Ursol ERN, Fourrine 99, Nako TRB, Zoba ERN, Durafur developer D, .alpha.-Naphthol, alpha-Hydroxynaphthalene, nchembio791-comp4, C.I. Oxidation Base 33, NAPHTHOL

Molecular Formula: C10H8OMolecular Weight: 144.169920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: KJCVRFUGPWSIIH-UHFFFAOYSA-N

• 2,3-Dihydroxynaphthalene
IUPAC Name: naphthalene-2,3-diol | CAS Registry Number: 92-44-4
Synonyms: Naphthalene-2,3-diol, 2,3-NAPHTHALENEDIOL, 2,3-Dihydroxynaphthlene, 2,3-Dihydroxynapthalene, Ambap1518, WLN: L66J CQ DQ, NSC 8707, 37760_FLUKA, 37761_FLUKA, CHEBI:38135, EINECS 202-156-7, NSC8707, 2,3-DIHYDROXY-NAPHTHALENE, AIDS042574, AIDS-042574, BRN 0742375, c1009, ZINC00388553, AI3-18148, LS-94571

Molecular Formula: C10H8O2Molecular Weight: 160.169320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: JRNGUTKWMSBIBF-UHFFFAOYSA-N

• 1,3-Dimethyladamantane
IUPAC Name: 1,3-dimethyladamantane | CAS Registry Number: 702-79-4
Synonyms: 1,3-DIMETHYLADAMANTANE, Adamantane, 1,3-dimethyl-, 187836_ALDRICH, CHEBI:47900, EINECS 211-870-8, TL8004959, 1,3-Dimethyltricyclo(3.3.1.13,7)decane, Tricyclo[3.3.1.1(3,7)]decane, 1,3-dimethyl-, 1,3-dimethyltricyclo[3.3.1.1(3,7)]decane

Molecular Formula: C12H20Molecular Weight: 164.287200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: CWNOIUTVJRWADX-UHFFFAOYSA-N

• 2,5-Dibromopyridine
IUPAC Name: 2,5-dibromopyridine | CAS Registry Number: 624-28-2
Synonyms: Ambap233, 2,5-Dibromo Pyridine, Pyridine, 2,5-dibromo-, D43107_ALDRICH, TPC-PY043, 34325_FLUKA, NSC76597, EINECS 210-839-6, ZINC00343301, D174, TL806124, AC-907/30002037

Molecular Formula: C5H3Br2NMolecular Weight: 236.892020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ZHXUWDPHUQHFOV-UHFFFAOYSA-N

• 1-Amino-2-Naphthol-4-Sulphonic Acid
IUPAC Name: 4-amino-3-hydroxynaphthalene-1-sulfonic acid | CAS Registry Number: 116-63-2
Synonyms: Ambap129, 1-Amino-4-sulfo-2-naphthol, 1,2,4-Acid, 1-Amino-2-naphthol-4-sulfonic acid, 4-Amino-3-hydroxy-1-naphthalenesulfonic acid, 109754_ALDRICH, 2-Hydroxy-4-sulfo-1-naphthylamine, 08751_FLUKA, CHEBI:19024, EINECS 204-147-3, NSC4986, NSC 25061, AIDS001789, 398969_SIAL, AIDS-001789, NSC25061, SBB008870, 4-Amino-3-hydroxynaphthalenesulfonic acid, 4-NH2-3-OH-naphthalenesulfonic acid, 4-Amino-3-hydroxynaphthalene-1-sulphonic acid

Molecular Formula: C10H9NO4SMolecular Weight: 239.247760 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: RXCMFQDTWCCLBL-UHFFFAOYSA-N

• 1-Ethyl-(3 Dimethylamino)Propyl Carbodiamide
IUPAC Name: 3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine hydrochloride | CAS Registry Number: 25952-53-8
Synonyms: EDCI, EDAC, Hydrochloride, EDAP, WLN: 2NCN3N1&1 &GH, NSC97064, [3-(Dimethylamino)propyl]ethyl carbodiimide hydrochloride, 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide hydrochloride, 1-Ethyl-3-(3′-dimethylaminopropyl)carbodiimide, HCl, 1-Ethyl-3-(3-dimethylaminopropyl)carbodiimide hydrochloride, N-ETHYL-N'(3-DIMETHYLAMINOPROPYL) CARBODIIMIDE HCl, 1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide hydrochloride, 1-Ethyl-3-(3-dimethylaminopropyl)carbodiimide monohydrochloride, 1-Ethyl-3-[(3-(dimethylamino)propyl]carbodiimide hydrochloride, 1-Ethyl-3-[3'-(dimethylamino)propyl]carbodiimide hydrochloride, Carbodiimide, [3-(dimethylamino)propyl]ethyl-, hydrochloride, N-[3-(Dimethylamino)propyl]-N'-ethylcarbodiimide hydrochloride, N-Ethyl-N'-(3-dimethylaminopropyl)carbodiimide hydrochloride, N-Ethyl-N'-[3-(dimethylamino)propyl]carbodiimide hydrochloride, 1-Ethyl-3-[3-(dimethylamino)propyl]carbodiimide monohydrochloride, CARBODIIMIDE, (3-DIMETHYLAMINOPROPYL)ETHYL-, HYDROCHLORIDE

Molecular Formula: C8H18ClN3Molecular Weight: 191.701620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FPQQSJJWHUJYPU-UHFFFAOYSA-N

• 1-Octane Sulphonic Acid Sodium Salt
IUPAC Name: sodium octane-1-sulfonate | CAS Registry Number: 5324-84-5
Synonyms: Sodium octylsulfonate, Sodium octanesulfonate, Sodium 1-octanesulfonate, sodium octane-1-sulfonate, O0133_SIAL, O8380_SIAL, 1-Octanesulfonic acid, sodium salt, 74886_FLUKA, Sodium 1-octanesulfonate solution, 1-Octanesulfonic acid sodium salt, NSC 2738, EINECS 226-195-4, Sodium octane-1-sulphonate monohydrate, 163883-56-5, 3944-72-7

Molecular Formula: C8H17NaO3SMolecular Weight: 216.273550 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HRQDCDQDOPSGBR-UHFFFAOYSA-M

• 2,6-Dichlorobenzaldehyde
IUPAC Name: 2,6-dichlorobenzaldehyde | CAS Registry Number: 83-38-5
Synonyms: 2,6-DICHLOROBENZALDEHYDE, Benzaldehyde, 2,6-dichloro-, CCRIS 6014, D56500_ALDRICH, NSC7193, NSC 7193, 35260_FLUKA, EINECS 201-472-2, CID6737, ZINC00148002, LS-1824, NCGC00091746-01, NCGC00091746-02, TL806122, ST5199694, InChI=1/C7H4Cl2O/c8-6-2-1-3-7(9)5(6)4-10/h1-4

Molecular Formula: C7H4Cl2OMolecular Weight: 175.012060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: DMIYKWPEFRFTPY-UHFFFAOYSA-N

• 6-Bromo-1-Hexanol
IUPAC Name: 6-bromohexan-1-ol | CAS Registry Number: 4286-55-9
Synonyms: 6-Bromohexanol, 6-Bromo-1-hexanol, 1-Hexanol, 6-bromo-, Hexamethylene bromohydrin, 6-BROMOHEXAN-1-OL, 186481_ALDRICH, CID77970, ZINC02242705, DB04637, BHL

Molecular Formula: C6H13BrOMolecular Weight: 181.070820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: FCMCSZXRVWDVAW-UHFFFAOYSA-N

• 1-benzylpiperazine
IUPAC Name: 1-(phenylmethyl)piperazine | CAS Registry Number: 2759-28-6
Synonyms: 1-Benzylpiperazine, N-benzylpiperazine, Benzylpiperazine, 4-Benzylpiperazine, Piperazine, 1-benzyl-, nchembio814-comp10, 1-(phenylmethyl)piperazine, Piperazine, polymer-bound, Piperazine, 1-(phenylmethyl)-, 526290_ALDRICH, 547549_ALDRICH, Piperazine, 1-benzyl- (8CI), 13815_FLUKA, EINECS 220-423-6, 1-Benzylpiperazine dihydrochloride, NSC 40889, NSC40889, EINECS 226-188-6, SBB007534, AI3-52573

Molecular Formula: C11H16N2Molecular Weight: 176.258140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IQXXEPZFOOTTBA-UHFFFAOYSA-N

• 2-(4-Methylphenyl)pyridine
IUPAC Name: 2-(4-methylphenyl)pyridine | CAS Registry Number: 4467-06-5
Synonyms: 2-p-Tolylpyridine, 2-(p-Tolyl)pyridine, Pyridine, 2-(4-methylphenyl)-, 198870_ALDRICH, AIDS020369, AIDS-020369, CID78219, EINECS 224-734-8, ZINC02564038, ST5406455

Molecular Formula: C12H11NMolecular Weight: 169.222440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: KJNZQKYSNAQLEO-UHFFFAOYSA-N

• 3-Thiopheneethanol
IUPAC Name: 2-thiophen-3-ylethanol | CAS Registry Number: 13781-67-4
Synonyms: 2-(3-Thienyl)ethanol, Thiophene-3-ethanol, Ambap1686, 3-(2-Hydroxyethyl)thiophene, 228796_ALDRICH, EINECS 237-434-7, ZINC00391956, InChI=1/C6H8OS/c7-3-1-6-2-4-8-5-6/h2,4-5,7H,1,3H

Molecular Formula: C6H8OSMolecular Weight: 128.192120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: YYPNNBPPDFTQFX-UHFFFAOYSA-N

• 1-Pyrenecarboxaldehyde
IUPAC Name: pyrene-1-carbaldehyde | CAS Registry Number: 3029-19-4
Synonyms: 4-Pyrenecarboxaldehyde, 1-Pyrene-carboxaldehyde, 1-PYRENECARBOXALDEHYDE, 144037_ALDRICH, 82654_FLUKA, NSC30811, ZINC01661349

Molecular Formula: C17H10OMolecular Weight: 230.260700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RCYFOPUXRMOLQM-UHFFFAOYSA-N

• 5-Chloro-1,3-dimethoxybenzene
IUPAC Name: 1-chloro-3,5-dimethoxybenzene | CAS Registry Number: 7051-16-3
Synonyms: 1-Chloro-3,5-dimethoxybenzene, 3,5-Dimethoxychlorobenzene, WLN: GR CO1 EO1, 5-Chlororesorcinol dimethyl ether, Benzene, 1-chloro-3,5-dimethoxy-, 209252_ALDRICH, EINECS 230-330-2, NSC220095, NSC 220095, CID81502, BRN 2327304, ZINC00407003, LS-29472, ST5406409, 4-06-00-05684 (Beilstein Handbook Reference)

Molecular Formula: C8H9ClO2Molecular Weight: 172.608860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WQHNWJBSROXROL-UHFFFAOYSA-N

• 10-Bromo-1-decanol
IUPAC Name: 10-bromodecan-1-ol | CAS Registry Number: 53463-68-6
Synonyms: 10-Bromodecanol, Decamethylene bromohydrin, 1-Decanol, 10-bromo-, 310891_ALDRICH, 16855_FLUKA, ZINC02579245, EINECS 258-572-4, CID104507

Molecular Formula: C10H21BrOMolecular Weight: 237.177140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: LGZMUUBPTDRQQM-UHFFFAOYSA-N

• 2,4-Diamino-6-(Hydroxymethyl)Pteridine
IUPAC Name: (2,4-diaminopteridin-6-yl)methanol | CAS Registry Number: 945-24-4
Synonyms: Oprea1_073806, 861634_ALDRICH, DC329, 2,4-Diamino-6-pteridinemethanol, 6-Hydroxymethyl-2,4-pteridinediamine, CHEBI:225655, AIDS007008, BB_NC-1270, 2,4-Diaminopteridine-6-ylmethanol, NSC 639363, AIDS-007008, CID70347, 6-Pteridinemethanol, 2,4-diamino-, EINECS 213-412-2, 2,4-Diamino-6-(hydroxymethyl)pteridine, NSC253944, NSC639363, ZINC00039586, NSC 253944, SD-096950

Molecular Formula: C7H8N6OMolecular Weight: 192.178020 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: CYNARAWTVHQHDI-UHFFFAOYSA-N

• 1,2-Epoxyoctadecane
IUPAC Name: 2-hexadecyloxirane | CAS Registry Number: 7390-81-0
Synonyms: Hexadecyloxirane, Oxirane, hexadecyl-, 2-Hexadecyloxirane, 1,2-EPOXYOCTADECANE, Oxirane, 2-hexadecyl-, CCRIS 2619, EINECS 230-977-0, CID23872, AI3-26311, LS-1628, 165323-66-0

Molecular Formula: C18H36OMolecular Weight: 268.477840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QBJWYMFTMJFGOL-UHFFFAOYSA-N

• 1-Naphthyl acetate
IUPAC Name: naphthalen-1-yl acetate | CAS Registry Number: 830-81-9
Synonyms: alpha-Naphthyl acetate, 1-Naphthol, acetate, a-Naphthyl acetate, 1-Acetoxynaphthalene, Naphthyl acetate, 1-Naphthylacetate, 1-Naphthyl a, alpha-Naphthol acetate, Naphthalene, 1-acetoxy-, alpha-Acetoxynaphthalene, Naphthalenol, acetate, 1-NAPHTHALENOL, ACETATE, .alpha.-Naphthyl acetate, Acetic acid 1-naphthyl ester, 1-Naphthalenol, 1-acetate, ALPHA-NAPHTHYL-ACETATE, 916_SIGMA, N8505_SIGMA, alpha-Naphthyl acetate solution, NSC 9846

Molecular Formula: C12H10O2Molecular Weight: 186.206600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VGKONPUVOVVNSU-UHFFFAOYSA-N

• 1-Hydroxyoctadecane
IUPAC Name: octadecan-1-ol | CAS Registry Number: 112-92-5
Synonyms: Stearyl alcohol, n-Octadecanol, Octadecanol, 1-OCTADECANOL, Stearol, Octadecan-1-ol, Steraffine, Polaax, Stenol, Octadecyl alcohol, Stearic alcohol, n-1-Octadecanol, Crodacol-S, Siponol S, Octadecylalkohol, Atalco S, Siponol SC, 1-0ctadecanol, n-Octadecyl alcohol, Lanol S

Molecular Formula: C18H38OMolecular Weight: 270.493720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: GLDOVTGHNKAZLK-UHFFFAOYSA-N

• 10-Undecenoic acid
IUPAC Name: undec-10-enoic acid | CAS Registry Number: 112-38-9
Synonyms: undecylenic acid, Renselin, Desenex, Sevinon, Declid, Undecenoic acid, 10-UNDECENOIC ACID, 10-Hendecenoic acid, 9-Undecylenic acid, Desenex solution, Cruex, Mixture Name, 10-Undecylenic acid, Undec-10-enoic acid, 10-Hendecenoic, Desenex, solution, Undecyl-10-enic acid, 1-Undecenoic acid, Caswell No. 901, Fulvidex (Veterinary)

Molecular Formula: C11H20O2Molecular Weight: 184.275300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FRPZMMHWLSIFAZ-UHFFFAOYSA-N

• 1-Octanol
IUPAC Name: octan-1-ol | CAS Registry Number: 111-87-5
Synonyms: 1-octanol, octanol, Octyl alcohol, N-octanol, caprylic alcohol, Octan-1-ol, Heptyl carbinol, Capryl alcohol, n-Octyl alcohol, Octilin, Alcohol C-8, 1-Hydroxyoctane, n-Octan-1-ol, n-Caprylic alcohol, Primary octyl alcohol, octyl-alcohol, Alfol 8, C8 alcohol, Sipol L8, n Octanol

Molecular Formula: C8H18OMolecular Weight: 130.227920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: KBPLFHHGFOOTCA-UHFFFAOYSA-N

• 6-Methoxy-1-Tetralone
IUPAC Name: 6-methoxy-3,4-dihydro-2H-naphthalen-1-one | CAS Registry Number: 1078-19-9
Synonyms: 6-Methoxy-1-tetralone, 6-Methoxy-.alpha.-tetralone, 6-methoxytetralin-1-one, 6-Methoxy-alpha-tetralone, M25589_ALDRICH, 1(2H)-Naphthalenone, 3,4-dihydro-6-methoxy-, AIDS017978, AIDS-017978, NSC41700, EINECS 214-078-0, NSC 41700, SBB007549, ZINC03850328, 6-Methoxy-3,4-dihydro-1(2H)-naphthalenone, 3,4-Dihydro-6-methoxy-1(2H)-naphthalenone, 6-methoxy-3,4-dihydro-2H-naphthalen-1-one, 6-Methoxy-3,4-dihydro-2H-naphthalin-1-on, 6-methoxy-3,4-dihydronaphthalen-1(2H)-one, 6-Methoxy-1,2,3,4-tetrahydro-1-naphthalenone, 6-Methoxy-1,2,3,4-tetrahydronaphthalen-1-one

Molecular Formula: C11H12O2Molecular Weight: 176.211780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MNALUTYMBUBKNX-UHFFFAOYSA-N

• 1,3-Dimethoxybenzene
IUPAC Name: 1,3-dimethoxybenzene | CAS Registry Number: 151-10-0
Synonyms: Benzene, m-dimethoxy-, 3-Methoxyanisole, Dimethyl resorcinol, Benzene, 1,3-dimethoxy-, Dimethylresorcinol, Methoxyanisole, m-, M-DIMETHOXYBENZENE, Resorcinol dimethyl ether, Ambap288, 3,5-Dimethoxybenzonitrile, FEMA No. 2385, W238503_ALDRICH, Dimethylether resorcinolu [Czech], 126306_ALDRICH, NSC 8699, 83610_FLUKA, EINECS 205-783-4, NSC8699, ZINC00388167, AI3-00845

Molecular Formula: C8H10O2Molecular Weight: 138.163800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DPZNOMCNRMUKPS-UHFFFAOYSA-N

• 1-Octyne
IUPAC Name: oct-1-yne | CAS Registry Number: 629-05-0
Synonyms: Hexylacetylene, 1-OCTYNE, oct-1-yne, Ambap4596, 244465_ALDRICH, 74970_FLUKA, EINECS 211-069-3, CID12370, BRN 1734494, LS-98155, TL8004312, 4-01-00-01034 (Beilstein Handbook Reference), InChI=1/C8H14/c1-3-5-7-8-6-4-2/h1H,4-8H2,2H, 32073-03-3

Molecular Formula: C8H14Molecular Weight: 110.196760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: UMIPWJGWASORKV-UHFFFAOYSA-N

• 2,4-Dimethylbenzaldehyde
IUPAC Name: 2,4-dimethylbenzaldehyde | CAS Registry Number: 15764-16-6
Synonyms: 2,4-Xylylaldehyde, Ambap5846, Benzaldehyde, 2,4-dimethyl-, W342718_ALDRICH, 1-Formyl-2,4-dimethylbenzene, FEMA No. 3427, 151041_ALDRICH, 2,4-Dimethylbenzenecarboxaldehyde, EINECS 239-856-7, ZINC01850617, InChI=1/C9H10O/c1-7-3-4-9(6-10)8(2)5-7/h3-6H,1-2H

Molecular Formula: C9H10OMolecular Weight: 134.175100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GISVICWQYMUPJF-UHFFFAOYSA-N

• (E)-Oct-2-enoic acid
IUPAC Name: (E)-oct-2-enoic acid | CAS Registry Number: 1871-67-6
Synonyms: 2-Octenoic acid, 2-Octenic acid, 2Z-octenoic acid, Oct-2-enoic acid, (2E)-2-Octenoic acid, trans-2-Octenoic acid, 2-Octenoic acid, (E)-, trans-alpha-octenoic acid, Oct-2-enoic acid (E), O5209_ALDRICH, EINECS 216-001-6, EINECS 217-491-4, LMFA01030018, 1470-50-4

Molecular Formula: C8H14O2Molecular Weight: 142.195560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CWMPPVPFLSZGCY-VOTSOKGWSA-N

• 1,7-Octadiyne
IUPAC Name: octa-1,7-diyne | CAS Registry Number: 871-84-1
Synonyms: octa-1,7-diyne, 161292_ALDRICH, NSC35135, EINECS 212-815-0, NSC 35135, InChI=1/C8H10/c1-3-5-7-8-6-4-2/h1-2H,5-8H

Molecular Formula: C8H10Molecular Weight: 106.165000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: DSOJWVLXZNRKCS-UHFFFAOYSA-N

• 1,2-Dimethylimidazole
IUPAC Name: 1,2-dimethylimidazole | CAS Registry Number: 1739-84-0
Synonyms: Imidazole, 1,2-dimethyl-, 1H-Imidazole, 1,2-dimethyl-, 1,2-METHYLIMIDAZOLE, 1,2-Dimethyl-1H-imidazole, 136131_ALDRICH, 1,2-DIMETHYL IMIDAZOLE, EINECS 217-101-2, NSC111174, NSC 111174, CID15617, Imidazole, 1,2-dimethyl- (8CI), LS-78497, ST5214411, TL8006091, 204854-16-0

Molecular Formula: C5H8N2Molecular Weight: 96.130420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: GIWQSPITLQVMSG-UHFFFAOYSA-N

• 2,3,5-Trimethylpyrazine
IUPAC Name: 2,3,5-trimethylpyrazine | CAS Registry Number: 14667-55-1
Synonyms: Pyrazine, trimethyl-, TRIMETHYLPYRAZINE, Ambap196, 2,3,5-Trimethyl pyrazine, 2,3,6-Trimethylpyrazine, FEMA No. 3244, CCRIS 2932, W324418_ALDRICH, W324426_ALDRICH, 199419_ALDRICH, EINECS 238-712-0, 2,3,5-Trimethyl pyrazine (natural), BRN 0002423, ZINC00406999, AI3-34442, LS-3140, 5-23-05-00419 (Beilstein Handbook Reference), InChI=1/C7H10N2/c1-5-4-8-6(2)7(3)9-5/h4H,1-3H, 124765-77-1

Molecular Formula: C7H10N2Molecular Weight: 122.167700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: IAEGWXHKWJGQAZ-UHFFFAOYSA-N

• 2,3-Dimethoxybenzaldehyde
IUPAC Name: 2,3-dimethoxybenzaldehyde | CAS Registry Number: 86-51-1
Synonyms: o-Veratraldehyde, Benzaldehyde, 2,3-dimethoxy-, UPCMLD00WStructure66, o-Veratraldehyde (8CI), Spectrum2_001964, D130206_ALDRICH, SPBio_002087, EINECS 201-677-7, NSC6314, NSC 403661, CID66581, NSC51953, NSC403661, ZINC00157156, Benzaldehyde, 2,3-dimethoxy- (9CI), AI3-00141, LS-25014, ST5213349, TL8007016, InChI=1/C9H10O3/c1-11-8-5-3-4-7(6-10)9(8)12-2/h3-6H,1-2H

Molecular Formula: C9H10O3Molecular Weight: 166.173900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: JIVGSHFYXPRRSZ-UHFFFAOYSA-N

• 2,4-Dihydroxybenzoic acid
IUPAC Name: 2,4-dihydroxybenzoic acid | CAS Registry Number: 89-86-1
Synonyms: beta-Resorcylic acid, 2,4-dihydroxybenzoic acid, 4-Carboxyresorcinol, p-Hydroxysalicylic acid, .beta.-Resorcylic acid, 4-Hydroxysalicylic acid, beta-Resorcinolic acid, Benzoic acid, 2,4-dihydroxy-, 2,4-Dhba, RESORCYLIC ACID, BETA, .beta.-Resorcinolic acid, Oprea1_259729, MLS001055408, D109401_ALDRICH, W379808_ALDRICH, 37530_FLUKA, EINECS 201-946-9, CID1491, NSC4740, NSC 13564

Molecular Formula: C7H6O4Molecular Weight: 154.120140 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: UIAFKZKHHVMJGS-UHFFFAOYSA-N

• 2-Aminobenzotrifluoride
IUPAC Name: 2-(trifluoromethyl)aniline | CAS Registry Number: 88-17-5
Synonyms: o-Aminobenzotrifluoride, o-Trifluoromethylaniline, o-(Trifluoromethyl)aniline, Benzenamine, 2-(trifluoromethyl)-, 2-Trifluoromethylaniline, 2-(TRIFLUOROMETHYL)ANILINE, 2-(Trifluoromethyl)benzenamine, CCRIS 2811, A41607_ALDRICH, alpha,alpha,alpha-Trifluoro-o-toluidine, 07040_FLUKA, EINECS 201-806-7, CID6922, NSC 10336, UN2942, NSC10336, SBB003955, ZINC00157590, AI3-26182, FR-0662

Molecular Formula: C7H6F3NMolecular Weight: 161.124450 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: VBLXCTYLWZJBKA-UHFFFAOYSA-N

• 3-Phenyl Propionyl Chloride
IUPAC Name: 3-phenylpropanoyl chloride | CAS Registry Number: 645-45-4
Synonyms: Hydrocinnamoyl chloride, Benzenepropanoyl chloride, Hydrocinnamyl chloride, 3-Phenylpropionyl chloride, 3-Phenylpropanoyl chloride, Dihydrocinnamoyl chloride, Propionyl chloride, 3-phenyl-, beta-Phenylpropanoyl chloride, beta-Phenylpropionyl chloride, .beta.-Phenylpropanoyl chloride, .beta.-Phenylpropionyl chloride, 249440_ALDRICH, NSC 2854, 56676_FLUKA, EINECS 211-443-6, NSC2854, CID64801, BRN 0742586, ZINC01641183, AI3-18968

Molecular Formula: C9H9ClOMolecular Weight: 168.620160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: MFEILWXBDBCWKF-UHFFFAOYSA-N

• 1-Heptanol
IUPAC Name: heptan-1-ol | CAS Registry Number: 111-70-6
Synonyms: Heptyl alcohol, n-Heptanol, Heptanol, 1-HEPTANOL, Heptan-1-ol, Gentanol, Enanthic alcohol, Hydroxyheptane, 1-Hydroxyheptane, n-Heptyl alcohol, Hydroxy heptane, Hexyl carbinol, Enanthyl alcohol, n-Heptan-1-ol, C7 alcohol, n Heptanol, Alcohol, Heptyl, Alcohol C-7, 1 Heptanol, Fatty alcohol(C7)

Molecular Formula: C7H16OMolecular Weight: 116.201340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: BBMCTIGTTCKYKF-UHFFFAOYSA-N

• 1-Adamantane Methanol
IUPAC Name: 1-adamantylmethanol | CAS Registry Number: 770-71-8
Synonyms: 1-Adamantanemethanol, Ambap5980, Enamine_000905, 1-Hydroxymethyladamantane, 1-(Hydroxymethyl)adamantane, 184209_ALDRICH, ZINC01271106, CID64556, EINECS 212-225-3, ST5202967, TL8005296, Tricyclo(3.3.1.1'3,7)dec-1-ylmethanol, Tricyclo[3.3.1.1(3,7)-]decane-1-methanol

Molecular Formula: C11H18OMolecular Weight: 166.260020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MDVGOOIANLZFCP-UHFFFAOYSA-N

• 2,3-Diaminonaphthalene
IUPAC Name: naphthalene-2,3-diamine | CAS Registry Number: 771-97-1
Synonyms: 2,3-Naphthalenediamine, 2,3-Naphthylenediamine, D2757_SIAL, 88461_FLUKA, EINECS 212-241-0, NSC 62692, NSC62692, SBB000127, ZINC00134238, LS-170545, C026373, InChI=1/C10H10N2/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h1-6H,11-12H, DAN

Molecular Formula: C10H10N2Molecular Weight: 158.199800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: XTBLDMQMUSHDEN-UHFFFAOYSA-N

• 2,5-Dimethylbenzaldehyde
IUPAC Name: 2,5-dimethylbenzaldehyde | CAS Registry Number: 5779-94-2
Synonyms: Isoxylaldehyde, Benzaldehyde, 2,5-dimethyl-, 2,5-DIMETHYLBENZALDEHYDE, 151068_ALDRICH, EINECS 227-303-2, SBB008435, ZINC02012003, FR-2051, InChI=1/C9H10O/c1-7-3-4-8(2)9(5-7)6-10/h3-6H,1-2H

Molecular Formula: C9H10OMolecular Weight: 134.175100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SMUVABOERCFKRW-UHFFFAOYSA-N

• 2,3,5-TribromoThiophene
IUPAC Name: 2,3,5-tribromothiophene | CAS Registry Number: 3141-24-0
Synonyms: 2,3,5-Tribromothiophene, Thiophene, 2,3,5-tribromo-, 172758_ALDRICH, EINECS 221-544-7, NSC263503, ZINC01558394, NSC 263503, AI3-62838, ST5408549, InChI=1/C4HBr3S/c5-2-1-3(6)8-4(2)7/h1

Molecular Formula: C4HBr3SMolecular Weight: 320.827740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: SKDNDSLDRLEELJ-UHFFFAOYSA-N

• 2,3-dimethylbenzaldehyde
IUPAC Name: 2,3-dimethylbenzaldehyde | CAS Registry Number: 5779-93-1
Synonyms: 2,3-Dimethylbenzaldehyde, o-Xylene-3-carboxaldehyde, Benzaldehyde, dimethyl-, Benzaldehyde, 2,3-dimethyl-, SBB062996, 28351-09-9, Hemellitaldehyde, Dimethylformylbenzene, PubChem3080, DIMETHYLBENZALDEHYDE, ACMC-1AKE8, AC1L1R6U, AC1Q2DP0, KSC206C0T, AGN-PC-0D91D9, 515353_ALDRICH, 2,3-DIMETHYLBENZALDEHYD, CTK1A6109, MolPort-001-769-837, ACT00386

Molecular Formula: C9H10OMolecular Weight: 134.175100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: UIFVCPMLQXKEEU-UHFFFAOYSA-N

• 1-bromononane
IUPAC Name: 1-bromononane | CAS Registry Number: 693-58-3
Synonyms: n-Nonyl bromide, 1-Bromononane, Nonyl bromide, Nonane, 1-bromo-, 1-Nonyl bromide, 1-n-Nonyl bromide, n-Nonyl-1-bromide, NONANE,1-BROMO, 1-BROMO-N-NONANE, B74607_ALDRICH, NSC5519, CID12742, NSC 5519, EINECS 211-755-2, TL8004853, InChI=1/C9H19Br/c1-2-3-4-5-6-7-8-9-10/h2-9H2,1H

Molecular Formula: C9H19BrMolecular Weight: 207.151160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: AYMUQTNXKPEMLM-UHFFFAOYSA-N

• 1,2-Epoxy-5-hexene
IUPAC Name: 2-but-3-enyloxirane | CAS Registry Number: 10353-53-4
Synonyms: Diallyl monoxide, Diallyl monooxide, 3-Butenyloxirane, 2-(3-Butenyl)oxirane, Oxirane, 3-butenyl-, 5,6-Epoxyhex-1-ene, 1-Hexene, 5,6-epoxy-, CCRIS 3748, Oxirane, 3-butenyl- (9CI), 260347_ALDRICH, EINECS 233-771-9, BRN 0104509, LS-75553, 5-17-01-00199 (Beilstein Handbook Reference)

Molecular Formula: C6H10OMolecular Weight: 98.143000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: MUUOUUYKIVSIAR-UHFFFAOYSA-N

• (chloromethylene)dimethyliminium Chloride
IUPAC Name: chloromethylidene(dimethyl)azanium | CAS Registry Number: 3724-43-4
Synonyms: ZINC02539429, CID77312

Molecular Formula: C3H7ClN+Molecular Weight: 92.547380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: RXFZQWIYCJKAMJ-UHFFFAOYSA-N

• 2,2-Dimethylglutaric Anhydride
IUPAC Name: 3,3-dimethyloxane-2,6-dione | CAS Registry Number: 2938-48-9
Synonyms: 2,2-Dimethylglutaric anhydride, D159603_ALDRICH, CID76247, NSC60199, EINECS 220-922-9, .alpha.,.alpha.-Dimethyl glutaric anhydride, alpha,alpha-DIMETHYLGLUTARIC ANHYDRIDE, Dihydro-3,3-dimethyl-2H-pyran-2,6(3H)-dione, 2H-Pyran-2,6(3H)-dione, dihydro-3,3-dimethyl-

Molecular Formula: C7H10O3Molecular Weight: 142.152500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: PAVNZLVXYJDFNR-UHFFFAOYSA-N


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