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Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.
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1,471 – 1,485 of 57,049 results
1,471

(S)-2-Amino-3-benzyloxy-1-propanol hydrochloride, 98+%, Thermo Scientific Chemicals

CAS: 61366-43-6 Molecular Formula: C10H16ClNO2 Molecular Weight (g/mol): 217.69 MDL Number: MFCD07368914 InChI Key: BJWHQBTUHVIRJJ-UHFFFAOYNA-N Synonym: s-2-amino-3-benzyloxy propan-1-ol hydrochloride,s-2-amino-3-benzyloxy-1-propanol hydrochloride,2s-2-amino-3-benzyloxy propan-1-ol hydrochloride,s---2-amino-3-benzyloxy-1-propanol??hcl,s-2-amino-3-benzyloxy-propan-1-ol hydrochloride,2s-2-amino-3-benzyloxy propan-1-ol-hydrogen chloride 1/1 PubChem CID: 53338757 SMILES: Cl.NC(CO)COCC1=CC=CC=C1

PubChem CID 53338757
CAS 61366-43-6
Molecular Weight (g/mol) 217.69
MDL Number MFCD07368914
SMILES Cl.NC(CO)COCC1=CC=CC=C1
Synonym s-2-amino-3-benzyloxy propan-1-ol hydrochloride,s-2-amino-3-benzyloxy-1-propanol hydrochloride,2s-2-amino-3-benzyloxy propan-1-ol hydrochloride,s---2-amino-3-benzyloxy-1-propanol??hcl,s-2-amino-3-benzyloxy-propan-1-ol hydrochloride,2s-2-amino-3-benzyloxy propan-1-ol-hydrogen chloride 1/1
InChI Key BJWHQBTUHVIRJJ-UHFFFAOYNA-N
Molecular Formula C10H16ClNO2
1,472

3-Bromoanisole, 99+%

CAS: 2398-37-0 Molecular Formula: C7H7BrO Molecular Weight (g/mol): 187.04 MDL Number: MFCD00000081 InChI Key: PLDWAJLZAAHOGG-UHFFFAOYSA-N Synonym: 3-bromoanisole,m-bromoanisole,3-methoxybromobenzene,3-bromo anisole,m-bromomethoxybenzene,benzene, 1-bromo-3-methoxy,anisole, m-bromo,3-methoxy-1-bromobenzene,m-methoxybromobenzene,meta-bromoanisole PubChem CID: 16971 IUPAC Name: 1-bromo-3-methoxybenzene SMILES: COC1=CC=CC(Br)=C1

PubChem CID 16971
CAS 2398-37-0
Molecular Weight (g/mol) 187.04
MDL Number MFCD00000081
SMILES COC1=CC=CC(Br)=C1
Synonym 3-bromoanisole,m-bromoanisole,3-methoxybromobenzene,3-bromo anisole,m-bromomethoxybenzene,benzene, 1-bromo-3-methoxy,anisole, m-bromo,3-methoxy-1-bromobenzene,m-methoxybromobenzene,meta-bromoanisole
IUPAC Name 1-bromo-3-methoxybenzene
InChI Key PLDWAJLZAAHOGG-UHFFFAOYSA-N
Molecular Formula C7H7BrO
1,473

1-(2-Bromoethoxy)-3-nitrobenzene, 97%, Thermo Scientific™

CAS: 13831-59-9 Molecular Formula: C8H8BrNO3 Molecular Weight (g/mol): 246.06 MDL Number: MFCD07783648 InChI Key: QBUSKXLDUNPEMZ-UHFFFAOYSA-N Synonym: 1-2-bromoethoxy-3-nitrobenzene,benzene,1-2-bromoethoxy-3-nitro,2-bromoethyl 3-nitrophenyl ether,acmc-209chl,2-bromo-3'-nitrophenetole,2-3-nitrophenoxy ethyl bromide,3-2-bromoethoxy-1-nitrobenzene PubChem CID: 269626 IUPAC Name: 1-(2-bromoethoxy)-3-nitrobenzene SMILES: [O-][N+](=O)C1=CC=CC(OCCBr)=C1

PubChem CID 269626
CAS 13831-59-9
Molecular Weight (g/mol) 246.06
MDL Number MFCD07783648
SMILES [O-][N+](=O)C1=CC=CC(OCCBr)=C1
Synonym 1-2-bromoethoxy-3-nitrobenzene,benzene,1-2-bromoethoxy-3-nitro,2-bromoethyl 3-nitrophenyl ether,acmc-209chl,2-bromo-3'-nitrophenetole,2-3-nitrophenoxy ethyl bromide,3-2-bromoethoxy-1-nitrobenzene
IUPAC Name 1-(2-bromoethoxy)-3-nitrobenzene
InChI Key QBUSKXLDUNPEMZ-UHFFFAOYSA-N
Molecular Formula C8H8BrNO3
1,474

(3-Methoxyphenyl)acetonitrile, 97%, Thermo Scientific™

CAS: 19924-43-7 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 MDL Number: MFCD00001910 InChI Key: LXKNAUOWEJWGTE-UHFFFAOYSA-N Synonym: 3-methoxyphenyl acetonitrile,2-3-methoxyphenyl acetonitrile,3-methoxyphenylacetonitrile,3-methoxybenzyl cyanide,m-methoxyphenyl acetonitrile,3-cyanomethyl anisole,benzeneacetonitrile, 3-methoxy,3-methoxybenzeneacetonitrile,m-methoxybenzyl cyanide,2-3-methoxyphenyl ethanenitrile PubChem CID: 88310 IUPAC Name: 2-(3-methoxyphenyl)acetonitrile SMILES: COC1=CC=CC(=C1)CC#N

PubChem CID 88310
CAS 19924-43-7
Molecular Weight (g/mol) 147.18
MDL Number MFCD00001910
SMILES COC1=CC=CC(=C1)CC#N
Synonym 3-methoxyphenyl acetonitrile,2-3-methoxyphenyl acetonitrile,3-methoxyphenylacetonitrile,3-methoxybenzyl cyanide,m-methoxyphenyl acetonitrile,3-cyanomethyl anisole,benzeneacetonitrile, 3-methoxy,3-methoxybenzeneacetonitrile,m-methoxybenzyl cyanide,2-3-methoxyphenyl ethanenitrile
IUPAC Name 2-(3-methoxyphenyl)acetonitrile
InChI Key LXKNAUOWEJWGTE-UHFFFAOYSA-N
Molecular Formula C9H9NO
1,475

2-Bromobenzylamine, 96%

CAS: 3959-05-5 Molecular Formula: C7H8BrN Molecular Weight (g/mol): 186.05 MDL Number: MFCD00025572 InChI Key: NOYASZMZIBFFNZ-UHFFFAOYSA-N Synonym: 2-bromobenzylamine,2-bromophenyl methanamine,o-bromobenzylamine,2-bromophenyl methylamine,1-2-bromophenyl methanamine,2-brobenzylamine,2-bromo-benzylamine,pubchem20398,acmc-1ct06,benzenemethanamine, 2-bromo PubChem CID: 334072 IUPAC Name: (2-bromophenyl)methanamine SMILES: C1=CC=C(C(=C1)CN)Br

PubChem CID 334072
CAS 3959-05-5
Molecular Weight (g/mol) 186.05
MDL Number MFCD00025572
SMILES C1=CC=C(C(=C1)CN)Br
Synonym 2-bromobenzylamine,2-bromophenyl methanamine,o-bromobenzylamine,2-bromophenyl methylamine,1-2-bromophenyl methanamine,2-brobenzylamine,2-bromo-benzylamine,pubchem20398,acmc-1ct06,benzenemethanamine, 2-bromo
IUPAC Name (2-bromophenyl)methanamine
InChI Key NOYASZMZIBFFNZ-UHFFFAOYSA-N
Molecular Formula C7H8BrN
1,476

4-n-Dodecylbenzoic acid, 98%

CAS: 21021-55-6 Molecular Formula: C19H30O2 Molecular Weight (g/mol): 290.447 MDL Number: MFCD04972235 InChI Key: JCHCIOJFCCQEKZ-UHFFFAOYSA-N Synonym: p-dodecylbenzoic acid,benzoic acid, 4-dodecyl,p-n-dodecyl benzoic acid,benzoicacid,4-dodecyl,4-n-dodecylbenzoic acid PubChem CID: 413311 IUPAC Name: 4-dodecylbenzoic acid SMILES: CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)O

PubChem CID 413311
CAS 21021-55-6
Molecular Weight (g/mol) 290.447
MDL Number MFCD04972235
SMILES CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)O
Synonym p-dodecylbenzoic acid,benzoic acid, 4-dodecyl,p-n-dodecyl benzoic acid,benzoicacid,4-dodecyl,4-n-dodecylbenzoic acid
IUPAC Name 4-dodecylbenzoic acid
InChI Key JCHCIOJFCCQEKZ-UHFFFAOYSA-N
Molecular Formula C19H30O2
1,477

2-Bromo-4-methoxybenzaldehyde, 98%

CAS: 43192-31-0 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.05 MDL Number: MFCD09788636 InChI Key: ODISAUHBLBVQKC-UHFFFAOYSA-N Synonym: benzaldehyde, 2-bromo-4-methoxy,benzaldehyde,2-bromo-4-methoxy,3-bromo-4-formylanisole, 2-bromo-p-anisaldehyde,pubchem12556,acmc-209jtd,ksc232o5d,2-bromanyl-4-methoxy-benzaldehyde PubChem CID: 11127641 IUPAC Name: 2-bromo-4-methoxybenzaldehyde SMILES: COC1=CC(Br)=C(C=O)C=C1

PubChem CID 11127641
CAS 43192-31-0
Molecular Weight (g/mol) 215.05
MDL Number MFCD09788636
SMILES COC1=CC(Br)=C(C=O)C=C1
Synonym benzaldehyde, 2-bromo-4-methoxy,benzaldehyde,2-bromo-4-methoxy,3-bromo-4-formylanisole, 2-bromo-p-anisaldehyde,pubchem12556,acmc-209jtd,ksc232o5d,2-bromanyl-4-methoxy-benzaldehyde
IUPAC Name 2-bromo-4-methoxybenzaldehyde
InChI Key ODISAUHBLBVQKC-UHFFFAOYSA-N
Molecular Formula C8H7BrO2
1,478

4-Ethoxy-3-methoxybenzaldehyde, 95%, Thermo Scientific™

CAS: 120-25-2 MDL Number: MFCD00016614 InChI Key: BERFDQAMXIBOHM-UHFFFAOYSA-N Synonym: 4-ethoxy-3-anisaldehyde,4-ethoxy-m-anisaldehyde,benzaldehyde, 4-ethoxy-3-methoxy,ethyl-vanillin,asischem n42243,4-ethoxy-3-methoxy-benzaldehyde,ethylvanillin?,4-ethoxyvanillin,vanillin ethyl ether,pubchem2648 PubChem CID: 67116 IUPAC Name: 4-ethoxy-3-methoxybenzaldehyde SMILES: CCOC1=C(C=C(C=C1)C=O)OC

PubChem CID 67116
CAS 120-25-2
MDL Number MFCD00016614
SMILES CCOC1=C(C=C(C=C1)C=O)OC
Synonym 4-ethoxy-3-anisaldehyde,4-ethoxy-m-anisaldehyde,benzaldehyde, 4-ethoxy-3-methoxy,ethyl-vanillin,asischem n42243,4-ethoxy-3-methoxy-benzaldehyde,ethylvanillin?,4-ethoxyvanillin,vanillin ethyl ether,pubchem2648
IUPAC Name 4-ethoxy-3-methoxybenzaldehyde
InChI Key BERFDQAMXIBOHM-UHFFFAOYSA-N
1,479

2,3,4-Trimethoxybenzaldehyde, 98+%

CAS: 2103-57-3 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 MDL Number: MFCD00003310 InChI Key: UCTUXUGXIFRVGX-UHFFFAOYSA-N Synonym: trimethoxybenzaldehyde,benzaldehyde, 2,3,4-trimethoxy,2,3,4-trimethoxy-benzaldehyde,benzaldehyde, trimethoxy,2,3,4 trimethoxybenzylaldehyde,pubchem8261,trimethoxy benzaldehyde,trimetazidine impurity c,acmc-1b07v,ksc201q5r PubChem CID: 75006 IUPAC Name: 2,3,4-trimethoxybenzaldehyde SMILES: COC1=C(C(=C(C=C1)C=O)OC)OC

PubChem CID 75006
CAS 2103-57-3
Molecular Weight (g/mol) 196.202
MDL Number MFCD00003310
SMILES COC1=C(C(=C(C=C1)C=O)OC)OC
Synonym trimethoxybenzaldehyde,benzaldehyde, 2,3,4-trimethoxy,2,3,4-trimethoxy-benzaldehyde,benzaldehyde, trimethoxy,2,3,4 trimethoxybenzylaldehyde,pubchem8261,trimethoxy benzaldehyde,trimetazidine impurity c,acmc-1b07v,ksc201q5r
IUPAC Name 2,3,4-trimethoxybenzaldehyde
InChI Key UCTUXUGXIFRVGX-UHFFFAOYSA-N
Molecular Formula C10H12O4
1,480

3-Bromo-4-methoxybenzaldehyde, 98%

CAS: 34841-06-0 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.05 MDL Number: MFCD00016599 InChI Key: QMPNFQLVIGPNEI-UHFFFAOYSA-N Synonym: 3-bromo-p-anisaldehyde,benzaldehyde, 3-bromo-4-methoxy,3-bromo-4-methoxy-benzaldehyde,3-bromoanisaldehyde,5-bromoanisaldehyde,3-bromo-anisaldehyde,5-bromo anisaldehyde,pubchem2643,acmc-209iat,2-bromo-4-formylanisole PubChem CID: 98662 IUPAC Name: 3-bromo-4-methoxybenzaldehyde SMILES: COC1=CC=C(C=O)C=C1Br

PubChem CID 98662
CAS 34841-06-0
Molecular Weight (g/mol) 215.05
MDL Number MFCD00016599
SMILES COC1=CC=C(C=O)C=C1Br
Synonym 3-bromo-p-anisaldehyde,benzaldehyde, 3-bromo-4-methoxy,3-bromo-4-methoxy-benzaldehyde,3-bromoanisaldehyde,5-bromoanisaldehyde,3-bromo-anisaldehyde,5-bromo anisaldehyde,pubchem2643,acmc-209iat,2-bromo-4-formylanisole
IUPAC Name 3-bromo-4-methoxybenzaldehyde
InChI Key QMPNFQLVIGPNEI-UHFFFAOYSA-N
Molecular Formula C8H7BrO2
1,481

Dicyclohexyl phthalate, 99%

CAS: 84-61-7 Molecular Formula: C20H26O4 Molecular Weight (g/mol): 330.42 MDL Number: MFCD00003849 InChI Key: VOWAEIGWURALJQ-UHFFFAOYSA-N Synonym: dicyclohexyl phthalate,ergoplast fdc,unimoll 66,ergoplast.fdc,howflex cp,phthalic acid, dicyclohexyl ester,phthalic acid dicyclohexyl ester,1,2-benzenedicarboxylic acid, dicyclohexyl ester,unii-cgd15m7h2n,ccris 6190 PubChem CID: 6777 ChEBI: CHEBI:34693 IUPAC Name: dicyclohexyl benzene-1,2-dicarboxylate SMILES: C1CCC(CC1)OC(=O)C2=CC=CC=C2C(=O)OC3CCCCC3

PubChem CID 6777
CAS 84-61-7
Molecular Weight (g/mol) 330.42
ChEBI CHEBI:34693
MDL Number MFCD00003849
SMILES C1CCC(CC1)OC(=O)C2=CC=CC=C2C(=O)OC3CCCCC3
Synonym dicyclohexyl phthalate,ergoplast fdc,unimoll 66,ergoplast.fdc,howflex cp,phthalic acid, dicyclohexyl ester,phthalic acid dicyclohexyl ester,1,2-benzenedicarboxylic acid, dicyclohexyl ester,unii-cgd15m7h2n,ccris 6190
IUPAC Name dicyclohexyl benzene-1,2-dicarboxylate
InChI Key VOWAEIGWURALJQ-UHFFFAOYSA-N
Molecular Formula C20H26O4
1,482

4-(Trifluoromethylthio)benzaldehyde, 90+%

CAS: 4021-50-5 Molecular Formula: C8H5F3OS Molecular Weight (g/mol): 206.18 MDL Number: MFCD00129191 InChI Key: OPAXHVNZGUGCKW-UHFFFAOYSA-N Synonym: 4-trifluoromethylthio benzaldehyde,4-trifluoromethyl thio benzaldehyde,4-trifluoromethyl sulfanyl benzaldehyde,benzaldehyde, 4-trifluoromethyl thio,acmc-1agrc,ksc582m6p,4-trifluomethylthio benzoldehyde,rarechem gt hw 0381 PubChem CID: 2777846 IUPAC Name: 4-(trifluoromethylsulfanyl)benzaldehyde SMILES: FC(F)(F)SC1=CC=C(C=O)C=C1

PubChem CID 2777846
CAS 4021-50-5
Molecular Weight (g/mol) 206.18
MDL Number MFCD00129191
SMILES FC(F)(F)SC1=CC=C(C=O)C=C1
Synonym 4-trifluoromethylthio benzaldehyde,4-trifluoromethyl thio benzaldehyde,4-trifluoromethyl sulfanyl benzaldehyde,benzaldehyde, 4-trifluoromethyl thio,acmc-1agrc,ksc582m6p,4-trifluomethylthio benzoldehyde,rarechem gt hw 0381
IUPAC Name 4-(trifluoromethylsulfanyl)benzaldehyde
InChI Key OPAXHVNZGUGCKW-UHFFFAOYSA-N
Molecular Formula C8H5F3OS
1,483

3-(2-Methyl-thiazol-4-yl)-benzaldehyde, 97%, Thermo Scientific™

CAS: 850375-05-2 Molecular Formula: C11H9NOS Molecular Weight (g/mol): 203.26 MDL Number: MFCD02681946 InChI Key: FQQPVEKQPGDYPD-UHFFFAOYSA-N PubChem CID: 7127782 IUPAC Name: 3-(2-methyl-1,3-thiazol-4-yl)benzaldehyde SMILES: CC1=NC(=CS1)C1=CC(C=O)=CC=C1

PubChem CID 7127782
CAS 850375-05-2
Molecular Weight (g/mol) 203.26
MDL Number MFCD02681946
SMILES CC1=NC(=CS1)C1=CC(C=O)=CC=C1
IUPAC Name 3-(2-methyl-1,3-thiazol-4-yl)benzaldehyde
InChI Key FQQPVEKQPGDYPD-UHFFFAOYSA-N
Molecular Formula C11H9NOS
1,484

2-Chloro-4-bromo-5-fluorobenzaldehyde, 98%

CAS: 1214386-29-4 Molecular Formula: C7H3BrClFO Molecular Weight (g/mol): 237.452 MDL Number: MFCD13185877 InChI Key: XPEGZWLIWARWAA-UHFFFAOYSA-N Synonym: 2-chloro-4-bromo-5-fluorobenzaldehyde PubChem CID: 70680695 IUPAC Name: 4-bromo-2-chloro-5-fluorobenzaldehyde SMILES: C1=C(C(=CC(=C1F)Br)Cl)C=O

PubChem CID 70680695
CAS 1214386-29-4
Molecular Weight (g/mol) 237.452
MDL Number MFCD13185877
SMILES C1=C(C(=CC(=C1F)Br)Cl)C=O
Synonym 2-chloro-4-bromo-5-fluorobenzaldehyde
IUPAC Name 4-bromo-2-chloro-5-fluorobenzaldehyde
InChI Key XPEGZWLIWARWAA-UHFFFAOYSA-N
Molecular Formula C7H3BrClFO
1,485

Benzoyl isothiocyanate, 98%

CAS: 532-55-8 Molecular Formula: C8H5NOS Molecular Weight (g/mol): 163.194 MDL Number: MFCD00004815 InChI Key: CPEKAXYCDKETEN-UHFFFAOYSA-N Synonym: benzoylthiocarbimide,benzoylisothiocyanate,benzoylisothiocyante,isothiocyanic acid benzoyl ester,unii-u8j7q32b86,n-benzoyl isothiocyanate,benzoic acid, anhydride with hncs,benzoic acid, anhydride with isothiocyanic acid,oxophenylmethanisothiocyanate,1-benzoyl acetone PubChem CID: 68284 IUPAC Name: benzoyl isothiocyanate SMILES: C1=CC=C(C=C1)C(=O)N=C=S

PubChem CID 68284
CAS 532-55-8
Molecular Weight (g/mol) 163.194
MDL Number MFCD00004815
SMILES C1=CC=C(C=C1)C(=O)N=C=S
Synonym benzoylthiocarbimide,benzoylisothiocyanate,benzoylisothiocyante,isothiocyanic acid benzoyl ester,unii-u8j7q32b86,n-benzoyl isothiocyanate,benzoic acid, anhydride with hncs,benzoic acid, anhydride with isothiocyanic acid,oxophenylmethanisothiocyanate,1-benzoyl acetone
IUPAC Name benzoyl isothiocyanate
InChI Key CPEKAXYCDKETEN-UHFFFAOYSA-N
Molecular Formula C8H5NOS