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Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.
Benzene and substituted derivatives (43)
Naphthalenes (6)
Phenols (6)
Anthracenes (3)
Pyrenes (3)
Phenanthrenes and derivatives (2)

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1 – 15 de 30 résultats
1

2-Iodoaniline, 98%

CAS: 615-43-0 Formule moléculaire: C6H6IN Poids moléculaire (g/mol): 219.03 Numéro MDL: MFCD00007680 Clé InChI: UBPDKIDWEADHPP-UHFFFAOYSA-N Synonyme: o-iodoaniline,benzenamine, 2-iodo,2-iodo aniline,2-iodobenzenamine,o-aminoiodobenzene,aniline, o-iodo,aniline, 2-iodo,benzenamine, iodo,2-iodo-phenylamine,2-iodophenylamine CID PubChem: 11995 Nom IUPAC: 2-iodoaniline SMILES: NC1=CC=CC=C1I

Poids moléculaire (g/mol) 219.03
Synonyme o-iodoaniline,benzenamine, 2-iodo,2-iodo aniline,2-iodobenzenamine,o-aminoiodobenzene,aniline, o-iodo,aniline, 2-iodo,benzenamine, iodo,2-iodo-phenylamine,2-iodophenylamine
Numéro MDL MFCD00007680
CAS 615-43-0
CID PubChem 11995
Nom IUPAC 2-iodoaniline
Clé InChI UBPDKIDWEADHPP-UHFFFAOYSA-N
SMILES NC1=CC=CC=C1I
Formule moléculaire C6H6IN
2

3-Nitrostyrene, 97%, stabilized

CAS: 586-39-0 Formule moléculaire: C8H7NO2 Poids moléculaire (g/mol): 149.15 Numéro MDL: MFCD00007276 Clé InChI: SYZVQXIUVGKCBJ-UHFFFAOYSA-N Synonyme: 3-nitrostyrene,1-nitro-3-vinylbenzene,m-nitrostyrene,benzene, 1-ethenyl-3-nitro,styrene, m-nitro,1-nitro-3-vinyl-benzene,3-nitrophenyl ethene,b-nitrostyrene,m-vinylnitrobenzene,3-ethenylnitrobenzene CID PubChem: 68514 Nom IUPAC: 1-ethenyl-3-nitrobenzene SMILES: C=CC1=CC(=CC=C1)[N+](=O)[O-]

Poids moléculaire (g/mol) 149.15
Synonyme 3-nitrostyrene,1-nitro-3-vinylbenzene,m-nitrostyrene,benzene, 1-ethenyl-3-nitro,styrene, m-nitro,1-nitro-3-vinyl-benzene,3-nitrophenyl ethene,b-nitrostyrene,m-vinylnitrobenzene,3-ethenylnitrobenzene
Numéro MDL MFCD00007276
CAS 586-39-0
CID PubChem 68514
Nom IUPAC 1-ethenyl-3-nitrobenzene
Clé InChI SYZVQXIUVGKCBJ-UHFFFAOYSA-N
SMILES C=CC1=CC(=CC=C1)[N+](=O)[O-]
Formule moléculaire C8H7NO2
3

4-Chloro-2-methyl-6-nitroaniline, 97%, Thermo Scientific™

CAS: 62790-50-5 Formule moléculaire: C7H7ClN2O2 Poids moléculaire (g/mol): 186.60 Numéro MDL: MFCD01320687 Clé InChI: QDSCDFKGUAONPC-UHFFFAOYSA-N Synonyme: 4-chloro-2-methyl-6-nitrophenylamine,acmc-1b9ic,2-amino-5-chloro-3-nitrotoluene,2-methyl-4-chloro-6-nitroaniline,4-chloro-2-methyl-6-nitrobenzenamine,2-amino-5-chloro-3-methylnitrobenzene,benzenamine,4-chloro-2-methyl-6-nitro,benzenamine, 4-chloro-2-methyl-6-nitro CID PubChem: 182355 Nom IUPAC: 4-chloro-2-methyl-6-nitroaniline SMILES: CC1=CC(Cl)=CC(=C1N)[N+]([O-])=O

Poids moléculaire (g/mol) 186.60
Synonyme 4-chloro-2-methyl-6-nitrophenylamine,acmc-1b9ic,2-amino-5-chloro-3-nitrotoluene,2-methyl-4-chloro-6-nitroaniline,4-chloro-2-methyl-6-nitrobenzenamine,2-amino-5-chloro-3-methylnitrobenzene,benzenamine,4-chloro-2-methyl-6-nitro,benzenamine, 4-chloro-2-methyl-6-nitro
Numéro MDL MFCD01320687
CAS 62790-50-5
CID PubChem 182355
Nom IUPAC 4-chloro-2-methyl-6-nitroaniline
Clé InChI QDSCDFKGUAONPC-UHFFFAOYSA-N
SMILES CC1=CC(Cl)=CC(=C1N)[N+]([O-])=O
Formule moléculaire C7H7ClN2O2
4

4-Chloro-1-naphthol, 97%

CAS: 604-44-4 Formule moléculaire: C10H7ClO Poids moléculaire (g/mol): 178.62 Numéro MDL: MFCD00003974 Clé InChI: LVSPDZAGCBEQAV-UHFFFAOYSA-N Synonyme: 4-chloro-1-naphthol,1-chloro-4-hydroxynaphthalene,1-naphthalenol, 4-chloro,4-chloro-1-naphthalenol,1-naphthol, 4-chloro,4-chloronaphthol,4-chloro-.alpha.-naphthol,4-chloro-1-hydroxynaphthalene,4-chloro-alpha-naphthol,acmc-20amm7 CID PubChem: 11787 Nom IUPAC: 4-chloronaphthalen-1-ol SMILES: C1=CC=C2C(=C1)C(=CC=C2Cl)O

Poids moléculaire (g/mol) 178.62
Synonyme 4-chloro-1-naphthol,1-chloro-4-hydroxynaphthalene,1-naphthalenol, 4-chloro,4-chloro-1-naphthalenol,1-naphthol, 4-chloro,4-chloronaphthol,4-chloro-.alpha.-naphthol,4-chloro-1-hydroxynaphthalene,4-chloro-alpha-naphthol,acmc-20amm7
Numéro MDL MFCD00003974
CAS 604-44-4
CID PubChem 11787
Nom IUPAC 4-chloronaphthalen-1-ol
Clé InChI LVSPDZAGCBEQAV-UHFFFAOYSA-N
SMILES C1=CC=C2C(=C1)C(=CC=C2Cl)O
Formule moléculaire C10H7ClO
5

1-Hydroxypyrene, 99+%

CAS: 5315-79-7 Formule moléculaire: C16H10O Poids moléculaire (g/mol): 218.25 Numéro MDL: MFCD00044543 Clé InChI: BIJNHUAPTJVVNQ-UHFFFAOYSA-N Synonyme: 1-hydroxypyrene,1-pyrenol,3-hydroxypyrene,pyrenol,unii-n2h6o5v707,hydroxypyrene,1-hydroxy-pyrene,3-pyrenol,1-pyrenol 8ci CID PubChem: 21387 ChEBI: CHEBI:34093 Nom IUPAC: pyren-1-ol SMILES: C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)O

Poids moléculaire (g/mol) 218.25
Synonyme 1-hydroxypyrene,1-pyrenol,3-hydroxypyrene,pyrenol,unii-n2h6o5v707,hydroxypyrene,1-hydroxy-pyrene,3-pyrenol,1-pyrenol 8ci
Numéro MDL MFCD00044543
CAS 5315-79-7
CID PubChem 21387
ChEBI CHEBI:34093
Nom IUPAC pyren-1-ol
Clé InChI BIJNHUAPTJVVNQ-UHFFFAOYSA-N
SMILES C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)O
Formule moléculaire C16H10O
6

trans-Styrylacetic acid, 96%

CAS: 1914-58-5 Formule moléculaire: C10H10O2 Poids moléculaire (g/mol): 162.19 Numéro MDL: MFCD00002783 Clé InChI: PSCXFXNEYIHJST-QPJJXVBHSA-N Synonyme: trans-styrylacetic acid,e-4-phenylbut-3-enoic acid,3e-4-phenylbut-3-enoic acid,4-phenyl-3-butenoic acid,3-butenoic acid, 4-phenyl,3-butenoic acid, 4-phenyl-, 3e,styrylacetic acid,e-4-phenyl-3-butenoic acid,e-styrylacetic acid CID PubChem: 5370625 SMILES: OC(=O)C\C=C\C1=CC=CC=C1

Poids moléculaire (g/mol) 162.19
Synonyme trans-styrylacetic acid,e-4-phenylbut-3-enoic acid,3e-4-phenylbut-3-enoic acid,4-phenyl-3-butenoic acid,3-butenoic acid, 4-phenyl,3-butenoic acid, 4-phenyl-, 3e,styrylacetic acid,e-4-phenyl-3-butenoic acid,e-styrylacetic acid
Numéro MDL MFCD00002783
CAS 1914-58-5
CID PubChem 5370625
Clé InChI PSCXFXNEYIHJST-QPJJXVBHSA-N
SMILES OC(=O)C\C=C\C1=CC=CC=C1
Formule moléculaire C10H10O2
7

9-Anthracenecarboxaldehyde, 99%

CAS: 642-31-9 Formule moléculaire: C15H10O Poids moléculaire (g/mol): 206.24 Numéro MDL: MFCD00001254 Clé InChI: YMNKUHIVVMFOFO-UHFFFAOYSA-N Synonyme: 9-anthraldehyde,9-anthracenecarboxaldehyde,9-anthrylaldehyde,9-formylanthracene,9-anthracenecarbaldehyde,9-anthrylcarboxaldehyde,ccris 3165,nsc 15,anthracene-9-aldehyde,anthracene-9-carboxaldehyde CID PubChem: 69504 Nom IUPAC: anthracene-9-carbaldehyde SMILES: O=CC1=C2C=CC=CC2=CC2=CC=CC=C12

Poids moléculaire (g/mol) 206.24
Synonyme 9-anthraldehyde,9-anthracenecarboxaldehyde,9-anthrylaldehyde,9-formylanthracene,9-anthracenecarbaldehyde,9-anthrylcarboxaldehyde,ccris 3165,nsc 15,anthracene-9-aldehyde,anthracene-9-carboxaldehyde
Numéro MDL MFCD00001254
CAS 642-31-9
CID PubChem 69504
Nom IUPAC anthracene-9-carbaldehyde
Clé InChI YMNKUHIVVMFOFO-UHFFFAOYSA-N
SMILES O=CC1=C2C=CC=CC2=CC2=CC=CC=C12
Formule moléculaire C15H10O
8

4,5-Dimethoxy-2-nitrobenzyl bromide, 97%

CAS: 53413-67-5 Formule moléculaire: C9H10BrNO4 Poids moléculaire (g/mol): 276.09 Clé InChI: UEKFEYNZISYRRH-UHFFFAOYSA-N Synonyme: 1-bromomethyl-4,5-dimethoxy-2-nitrobenzene,4,5-dimethoxy-2-nitrobenzyl bromide,1-bromomethyl-2-nitro-4,5-dimethoxybenzene,bmndmb,benzene, 1-bromomethyl-4,5-dimethoxy-2-nitro,6-nitroveratryl bromide,acmc-1ao6p,4,5-dimenoxy-2-nitrobenzyl bromide,2-nitro-4,5-dimethoxybenzyl bromide,1-bromomethyl-4,5-dimethoxynitrobenzene CID PubChem: 3016812 Nom IUPAC: 1-(bromomethyl)-4,5-dimethoxy-2-nitrobenzene SMILES: COC1=C(C=C(C(=C1)CBr)[N+](=O)[O-])OC

Poids moléculaire (g/mol) 276.09
Synonyme 1-bromomethyl-4,5-dimethoxy-2-nitrobenzene,4,5-dimethoxy-2-nitrobenzyl bromide,1-bromomethyl-2-nitro-4,5-dimethoxybenzene,bmndmb,benzene, 1-bromomethyl-4,5-dimethoxy-2-nitro,6-nitroveratryl bromide,acmc-1ao6p,4,5-dimenoxy-2-nitrobenzyl bromide,2-nitro-4,5-dimethoxybenzyl bromide,1-bromomethyl-4,5-dimethoxynitrobenzene
CAS 53413-67-5
CID PubChem 3016812
Nom IUPAC 1-(bromomethyl)-4,5-dimethoxy-2-nitrobenzene
Clé InChI UEKFEYNZISYRRH-UHFFFAOYSA-N
SMILES COC1=C(C=C(C(=C1)CBr)[N+](=O)[O-])OC
Formule moléculaire C9H10BrNO4
9

2,3-Dicyanohydroquinone, 98%

CAS: 4733-50-0 Numéro MDL: MFCD00001790 Clé InChI: MPAIWVOBMLSHQA-UHFFFAOYSA-N Synonyme: 2,3-dicyanohydroquinone,3,6-dihydroxyphthalonitrile,2,3-dicyano-p-hydroquinone,3,6-dihydroxyphthalodinitrile,1,2-benzenedicarbonitrile, 3,6-dihydroxy,2,3-dicyanobenzene-1,4-diol,phthalonitrile, 3,6-dihydroxy,dicyanohydroquinone,2,3-dicyanohydroquinme,acmc-1asrw CID PubChem: 78467 Nom IUPAC: 3,6-dihydroxybenzene-1,2-dicarbonitrile SMILES: C1=CC(=C(C(=C1O)C#N)C#N)O

Synonyme 2,3-dicyanohydroquinone,3,6-dihydroxyphthalonitrile,2,3-dicyano-p-hydroquinone,3,6-dihydroxyphthalodinitrile,1,2-benzenedicarbonitrile, 3,6-dihydroxy,2,3-dicyanobenzene-1,4-diol,phthalonitrile, 3,6-dihydroxy,dicyanohydroquinone,2,3-dicyanohydroquinme,acmc-1asrw
Numéro MDL MFCD00001790
CAS 4733-50-0
CID PubChem 78467
Nom IUPAC 3,6-dihydroxybenzene-1,2-dicarbonitrile
Clé InChI MPAIWVOBMLSHQA-UHFFFAOYSA-N
SMILES C1=CC(=C(C(=C1O)C#N)C#N)O
10

4-Iodoaniline, 99%

CAS: 540-37-4 Formule moléculaire: C6H6IN Poids moléculaire (g/mol): 219.02 Clé InChI: VLVCDUSVTXIWGW-UHFFFAOYSA-N Synonyme: p-iodoaniline,benzenamine, 4-iodo,4-iodobenzenamine,aniline, p-iodo,p-aminophenyl iodide,aniline, 4-iodo,4-iodo-aniline,4-iodophenylamine,4-iodo-benzenamine,4-iodo-phenylamine CID PubChem: 10893 Nom IUPAC: 4-iodoaniline SMILES: C1=CC(=CC=C1N)I

Poids moléculaire (g/mol) 219.02
Synonyme p-iodoaniline,benzenamine, 4-iodo,4-iodobenzenamine,aniline, p-iodo,p-aminophenyl iodide,aniline, 4-iodo,4-iodo-aniline,4-iodophenylamine,4-iodo-benzenamine,4-iodo-phenylamine
CAS 540-37-4
CID PubChem 10893
Nom IUPAC 4-iodoaniline
Clé InChI VLVCDUSVTXIWGW-UHFFFAOYSA-N
SMILES C1=CC(=CC=C1N)I
Formule moléculaire C6H6IN
11

2-Fluorobenzoic acid, 99%

CAS: 445-29-4 Formule moléculaire: C7H5FO2 Poids moléculaire (g/mol): 140.11 Numéro MDL: MFCD00002405 Clé InChI: NSTREUWFTAOOKS-UHFFFAOYSA-N Synonyme: o-fluorobenzoic acid,benzoic acid, 2-fluoro,ortho-fluorobenzoic acid,o-fluorbenzoesaeure,benzoic acid, o-fluoro,fluorobenzoic acid,unii-64uz32koo4,o-fluorbenzoesaeure german,ofba,2-fluoro-benzoic acid CID PubChem: 9935 ChEBI: CHEBI:19577 Nom IUPAC: 2-fluorobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)F

Poids moléculaire (g/mol) 140.11
Synonyme o-fluorobenzoic acid,benzoic acid, 2-fluoro,ortho-fluorobenzoic acid,o-fluorbenzoesaeure,benzoic acid, o-fluoro,fluorobenzoic acid,unii-64uz32koo4,o-fluorbenzoesaeure german,ofba,2-fluoro-benzoic acid
Numéro MDL MFCD00002405
CAS 445-29-4
CID PubChem 9935
ChEBI CHEBI:19577
Nom IUPAC 2-fluorobenzoic acid
Clé InChI NSTREUWFTAOOKS-UHFFFAOYSA-N
SMILES C1=CC=C(C(=C1)C(=O)O)F
Formule moléculaire C7H5FO2
12

(R)-(-)-alpha-Methoxyphenylacetic acid, 99%

CAS: 3966-32-3 Formule moléculaire: C9H10O3 Poids moléculaire (g/mol): 166.18 Numéro MDL: MFCD00004250 Clé InChI: DIWVBIXQCNRCFE-MRVPVSSYSA-N Synonyme: r---alpha-methoxyphenylacetic acid,r-2-methoxy-2-phenylacetic acid,2r-2-methoxy-2-phenylacetic acid,r-methoxyphenylacetic acid,r-methoxy phenyl acetic acid,methoxy phenyl acetic acid #,r---.alpha.-methoxyphenylacetic acid,benzeneacetic acid, .alpha.-methoxy-, r,o-methyl-d-mandelic acid,ksc496q9j CID PubChem: 2724294 Nom IUPAC: (2R)-2-methoxy-2-phenylacetic acid SMILES: COC(C1=CC=CC=C1)C(=O)O

Poids moléculaire (g/mol) 166.18
Synonyme r---alpha-methoxyphenylacetic acid,r-2-methoxy-2-phenylacetic acid,2r-2-methoxy-2-phenylacetic acid,r-methoxyphenylacetic acid,r-methoxy phenyl acetic acid,methoxy phenyl acetic acid #,r---.alpha.-methoxyphenylacetic acid,benzeneacetic acid, .alpha.-methoxy-, r,o-methyl-d-mandelic acid,ksc496q9j
Numéro MDL MFCD00004250
CAS 3966-32-3
CID PubChem 2724294
Nom IUPAC (2R)-2-methoxy-2-phenylacetic acid
Clé InChI DIWVBIXQCNRCFE-MRVPVSSYSA-N
SMILES COC(C1=CC=CC=C1)C(=O)O
Formule moléculaire C9H10O3
13

3-Iodobenzaldehyde, 99%

CAS: 696-41-3 Formule moléculaire: C7H5IO Poids moléculaire (g/mol): 232.02 Numéro MDL: MFCD00039573 Clé InChI: RZODAQZAFOBFLS-UHFFFAOYSA-N Synonyme: 3-iodo-benzaldehyde,3-iodbenzaldehyd,benzaldehyde, 3-iodo,3-iodo benzaldehyde,3-iodanylbenzaldehyde,pubchem3917,acmc-1atsd,1-formyl-3-iodobenzene,m-iodobenzaldehyde,3-iodobenzaldehyde CID PubChem: 252610 Nom IUPAC: 3-iodobenzaldehyde SMILES: C1=CC(=CC(=C1)I)C=O

Poids moléculaire (g/mol) 232.02
Synonyme 3-iodo-benzaldehyde,3-iodbenzaldehyd,benzaldehyde, 3-iodo,3-iodo benzaldehyde,3-iodanylbenzaldehyde,pubchem3917,acmc-1atsd,1-formyl-3-iodobenzene,m-iodobenzaldehyde,3-iodobenzaldehyde
Numéro MDL MFCD00039573
CAS 696-41-3
CID PubChem 252610
Nom IUPAC 3-iodobenzaldehyde
Clé InChI RZODAQZAFOBFLS-UHFFFAOYSA-N
SMILES C1=CC(=CC(=C1)I)C=O
Formule moléculaire C7H5IO
14

1,2,4,5-Tetrabromobenzene, 97%

CAS: 636-28-2 Formule moléculaire: C6H2Br4 Poids moléculaire (g/mol): 393.70 Numéro MDL: MFCD00000063 Clé InChI: QCKHVNQHBOGZER-UHFFFAOYSA-N CID PubChem: 12486 Nom IUPAC: 1,2,4,5-tetrabromobenzene SMILES: BrC1=CC(Br)=C(Br)C=C1Br

Poids moléculaire (g/mol) 393.70
Numéro MDL MFCD00000063
CAS 636-28-2
CID PubChem 12486
Nom IUPAC 1,2,4,5-tetrabromobenzene
Clé InChI QCKHVNQHBOGZER-UHFFFAOYSA-N
SMILES BrC1=CC(Br)=C(Br)C=C1Br
Formule moléculaire C6H2Br4
15

2-Methyl-4-nitroaniline, 99%

CAS: 99-52-5 Formule moléculaire: C7H8N2O2 Poids moléculaire (g/mol): 152.15 Numéro MDL: MFCD00007734 Clé InChI: XTTIQGSLJBWVIV-UHFFFAOYSA-N Synonyme: 2-amino-5-nitrotoluene,4-nitro-o-toluidine,5-nitro-2-aminotoluene,p-nitro-o-toluidine,benzenamine, 2-methyl-4-nitro,fast red rl base,1-amino-2-methyl-4-nitrobenzene,diabase red rl,ansibases red rl,devol red rl CID PubChem: 7441 Nom IUPAC: 2-methyl-4-nitroaniline SMILES: CC1=CC(=CC=C1N)[N+]([O-])=O

Poids moléculaire (g/mol) 152.15
Synonyme 2-amino-5-nitrotoluene,4-nitro-o-toluidine,5-nitro-2-aminotoluene,p-nitro-o-toluidine,benzenamine, 2-methyl-4-nitro,fast red rl base,1-amino-2-methyl-4-nitrobenzene,diabase red rl,ansibases red rl,devol red rl
Numéro MDL MFCD00007734
CAS 99-52-5
CID PubChem 7441
Nom IUPAC 2-methyl-4-nitroaniline
Clé InChI XTTIQGSLJBWVIV-UHFFFAOYSA-N
SMILES CC1=CC(=CC=C1N)[N+]([O-])=O
Formule moléculaire C7H8N2O2