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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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3,181 – 3,195 of 57,266 results
3,181

2,3,5,6-Tetrafluorobenzyl alcohol, 98%

CAS: 4084-38-2 Molecular Formula: C7H4F4O Molecular Weight (g/mol): 180.10 MDL Number: MFCD00792428 InChI Key: AGWVQASYTKCTCC-UHFFFAOYSA-N PubChem CID: 2734029 IUPAC Name: (2,3,5,6-tetrafluorophenyl)methanol SMILES: OCC1=C(F)C(F)=CC(F)=C1F

PubChem CID 2734029
CAS 4084-38-2
Molecular Weight (g/mol) 180.10
MDL Number MFCD00792428
SMILES OCC1=C(F)C(F)=CC(F)=C1F
IUPAC Name (2,3,5,6-tetrafluorophenyl)methanol
InChI Key AGWVQASYTKCTCC-UHFFFAOYSA-N
Molecular Formula C7H4F4O
3,182

Terephthaldehyde monodiethylacetal, 97%, stabilized

CAS: 81172-89-6 Molecular Formula: C12H16O3 Molecular Weight (g/mol): 208.26 MDL Number: MFCD00010217 InChI Key: HTMXMFARWHNJDW-UHFFFAOYSA-N Synonym: 4-diethoxymethyl benzaldehyde,terephthalaldehyde mono diethyl acetal,benzaldehyde, 4-diethoxymethyl,terephthaldehyde mono diethyl acetal,terephthalaldehyde mono-diethyl acetal,pubchem22621,acmc-209tbs,4-diethoxymethyl-benzaldehyde,4-diethoxymethy benzaldehyde,4-diethyoxymethyl benzaldehyde PubChem CID: 595993 IUPAC Name: 4-(diethoxymethyl)benzaldehyde SMILES: CCOC(OCC)C1=CC=C(C=O)C=C1

PubChem CID 595993
CAS 81172-89-6
Molecular Weight (g/mol) 208.26
MDL Number MFCD00010217
SMILES CCOC(OCC)C1=CC=C(C=O)C=C1
Synonym 4-diethoxymethyl benzaldehyde,terephthalaldehyde mono diethyl acetal,benzaldehyde, 4-diethoxymethyl,terephthaldehyde mono diethyl acetal,terephthalaldehyde mono-diethyl acetal,pubchem22621,acmc-209tbs,4-diethoxymethyl-benzaldehyde,4-diethoxymethy benzaldehyde,4-diethyoxymethyl benzaldehyde
IUPAC Name 4-(diethoxymethyl)benzaldehyde
InChI Key HTMXMFARWHNJDW-UHFFFAOYSA-N
Molecular Formula C12H16O3
3,183

5-Chloro-2-hydroxybenzyl alcohol, 98%

CAS: 5330-38-1 Molecular Formula: C7H7ClO2 Molecular Weight (g/mol): 158.581 MDL Number: MFCD00021967 InChI Key: AFPSETMCMFRVPG-UHFFFAOYSA-N Synonym: 5-chlorosalicyl alcohol,4-chloro-2-hydroxymethyl phenol,5-chloro-2-hydroxybenzyl alcohol,benzenemethanol, 5-chloro-2-hydroxy,benzenemethanol,5-chloro-2-hydroxy,5-chlorosaligenin,5-chlorosalicylalcohol,saligenin, 5-chloro,5-chloro-2-hydroxyphenyl methanol,5-chloro-2-hydroxyphenylmethyl carbinol PubChem CID: 79238 IUPAC Name: 4-chloro-2-(hydroxymethyl)phenol SMILES: C1=CC(=C(C=C1Cl)CO)O

PubChem CID 79238
CAS 5330-38-1
Molecular Weight (g/mol) 158.581
MDL Number MFCD00021967
SMILES C1=CC(=C(C=C1Cl)CO)O
Synonym 5-chlorosalicyl alcohol,4-chloro-2-hydroxymethyl phenol,5-chloro-2-hydroxybenzyl alcohol,benzenemethanol, 5-chloro-2-hydroxy,benzenemethanol,5-chloro-2-hydroxy,5-chlorosaligenin,5-chlorosalicylalcohol,saligenin, 5-chloro,5-chloro-2-hydroxyphenyl methanol,5-chloro-2-hydroxyphenylmethyl carbinol
IUPAC Name 4-chloro-2-(hydroxymethyl)phenol
InChI Key AFPSETMCMFRVPG-UHFFFAOYSA-N
Molecular Formula C7H7ClO2
3,184

4-Bromomethyl-3-fluorobenzonitrile, 95%, Thermo Scientific Chemicals

CAS: 105942-09-4 Molecular Formula: C8H5BrFN Molecular Weight (g/mol): 214.04 MDL Number: MFCD07368341 InChI Key: ZESZAIOGACKOMB-UHFFFAOYSA-N Synonym: 4-bromomethyl-3-fluorobenzonitrile,4-cyano-2-fluorobenzyl bromide,2-fluoro-4-cyanobenzyl bromide,2-fluoro-4-cyanbenzyl bromide,benzonitrile, 4-bromomethyl-3-fluoro,2-fluoro-4-cyanobenzylbromide,3-fluoro-4-bromomethyl benzonitrile,4-bromomethyl-3-fluoro-benzonitrile,4-bromomethyl-3-fluorobenzenecarbonitrile,pubchem4907 PubChem CID: 2783149 IUPAC Name: 4-(bromomethyl)-3-fluorobenzonitrile SMILES: FC1=C(CBr)C=CC(=C1)C#N

PubChem CID 2783149
CAS 105942-09-4
Molecular Weight (g/mol) 214.04
MDL Number MFCD07368341
SMILES FC1=C(CBr)C=CC(=C1)C#N
Synonym 4-bromomethyl-3-fluorobenzonitrile,4-cyano-2-fluorobenzyl bromide,2-fluoro-4-cyanobenzyl bromide,2-fluoro-4-cyanbenzyl bromide,benzonitrile, 4-bromomethyl-3-fluoro,2-fluoro-4-cyanobenzylbromide,3-fluoro-4-bromomethyl benzonitrile,4-bromomethyl-3-fluoro-benzonitrile,4-bromomethyl-3-fluorobenzenecarbonitrile,pubchem4907
IUPAC Name 4-(bromomethyl)-3-fluorobenzonitrile
InChI Key ZESZAIOGACKOMB-UHFFFAOYSA-N
Molecular Formula C8H5BrFN
3,185

2-Fluoro-4-methoxyphenylacetonitrile, 97%

CAS: 749934-29-0 Molecular Formula: C9H8FNO Molecular Weight (g/mol): 165.17 MDL Number: MFCD09038467 InChI Key: OKPZYRPNHFQVMZ-UHFFFAOYSA-N Synonym: 4-methoxy-2-fluorobenzyl cyanide,2-2-fluoro-4-methoxyphenyl acetonitrile,2-fluoro-4-methoxyphenylacetonitrile,2-fluoro-4-methoxybenzyl cyanide,2-fluoro-4-methoxybenzeneacetonitrile,2-fluoro-4-methoxyphenyl acetonitrile,2-fluoro-4-methoxy-phenyl-acetonitrile,2-2-fluoro-4-methoxyphenyl ethanenitrile,2-2-fluoranyl-4-methoxy-phenyl ethanenitrile,benzeneacetonitrile, 2-fluoro-4-methoxy-9ci PubChem CID: 26343860 IUPAC Name: 2-(2-fluoro-4-methoxyphenyl)acetonitrile SMILES: COC1=CC(F)=C(CC#N)C=C1

PubChem CID 26343860
CAS 749934-29-0
Molecular Weight (g/mol) 165.17
MDL Number MFCD09038467
SMILES COC1=CC(F)=C(CC#N)C=C1
Synonym 4-methoxy-2-fluorobenzyl cyanide,2-2-fluoro-4-methoxyphenyl acetonitrile,2-fluoro-4-methoxyphenylacetonitrile,2-fluoro-4-methoxybenzyl cyanide,2-fluoro-4-methoxybenzeneacetonitrile,2-fluoro-4-methoxyphenyl acetonitrile,2-fluoro-4-methoxy-phenyl-acetonitrile,2-2-fluoro-4-methoxyphenyl ethanenitrile,2-2-fluoranyl-4-methoxy-phenyl ethanenitrile,benzeneacetonitrile, 2-fluoro-4-methoxy-9ci
IUPAC Name 2-(2-fluoro-4-methoxyphenyl)acetonitrile
InChI Key OKPZYRPNHFQVMZ-UHFFFAOYSA-N
Molecular Formula C9H8FNO
3,186

3-(Dimethylamino)benzyl alcohol, 95%

CAS: 23501-93-1 Molecular Formula: C9H13NO Molecular Weight (g/mol): 151.21 MDL Number: MFCD00017342 InChI Key: YTUXZVSDDHCTBZ-UHFFFAOYSA-N Synonym: 3-dimethylamino phenyl methanol,3-dimethylamino benzyl alcohol,3-dimethylaminobenzyl alcohol,m-dimethylamino benzyl alcohol,benzenemethanol,3-dimethylamino,3-dimethylamino phenyl methan-1-ol,benzyl alcohol, m-dimethylamino,benzenemethanol, 3-dimethylamino PubChem CID: 90133 IUPAC Name: [3-(dimethylamino)phenyl]methanol SMILES: CN(C)C1=CC=CC(=C1)CO

PubChem CID 90133
CAS 23501-93-1
Molecular Weight (g/mol) 151.21
MDL Number MFCD00017342
SMILES CN(C)C1=CC=CC(=C1)CO
Synonym 3-dimethylamino phenyl methanol,3-dimethylamino benzyl alcohol,3-dimethylaminobenzyl alcohol,m-dimethylamino benzyl alcohol,benzenemethanol,3-dimethylamino,3-dimethylamino phenyl methan-1-ol,benzyl alcohol, m-dimethylamino,benzenemethanol, 3-dimethylamino
IUPAC Name [3-(dimethylamino)phenyl]methanol
InChI Key YTUXZVSDDHCTBZ-UHFFFAOYSA-N
Molecular Formula C9H13NO
3,187

2,5-Dimethylbenzyl chloride, 98%

CAS: 824-45-3 Molecular Formula: C9H11Cl Molecular Weight (g/mol): 154.637 MDL Number: MFCD00000902 InChI Key: PECXPZGFZFGDRD-UHFFFAOYSA-N Synonym: 2,5-dimethylbenzyl chloride,2-chloromethyl-1,4-dimethylbenzene,1-chloromethyl-2,5-dimethylbenzene,2-chloromethyl-p-xylene,benzene, 2-chloromethyl-1,4-dimethyl,2-chloromethyl-1,4-dimethyl-benzene,benzenemethanol,2-bromo-5-fluoro,2,5-dimethylbenzylchloride,acmc-209poz,2.5-dimethylbenzylchloride PubChem CID: 69987 IUPAC Name: 2-(chloromethyl)-1,4-dimethylbenzene SMILES: CC1=CC(=C(C=C1)C)CCl

PubChem CID 69987
CAS 824-45-3
Molecular Weight (g/mol) 154.637
MDL Number MFCD00000902
SMILES CC1=CC(=C(C=C1)C)CCl
Synonym 2,5-dimethylbenzyl chloride,2-chloromethyl-1,4-dimethylbenzene,1-chloromethyl-2,5-dimethylbenzene,2-chloromethyl-p-xylene,benzene, 2-chloromethyl-1,4-dimethyl,2-chloromethyl-1,4-dimethyl-benzene,benzenemethanol,2-bromo-5-fluoro,2,5-dimethylbenzylchloride,acmc-209poz,2.5-dimethylbenzylchloride
IUPAC Name 2-(chloromethyl)-1,4-dimethylbenzene
InChI Key PECXPZGFZFGDRD-UHFFFAOYSA-N
Molecular Formula C9H11Cl
3,188

2-(Bromomethyl)benzeneboronic acid, 97%

CAS: 91983-14-1 Molecular Formula: C7H8BBrO2 Molecular Weight (g/mol): 214.85 MDL Number: MFCD01318941 InChI Key: MYVJCOQGXCONPE-UHFFFAOYSA-N Synonym: 2-bromomethylphenylboronic acid,2-bromomethyl benzeneboronic acid,2-bromomethyl phenylboronic acid,2-bromomethyl phenyl boronic acid,2-bromomethylphenylboronicacid,2-boronobenzyl bromide,o-boronobenzyl bromide,2-bromomethylphenyl boronic acid,pubchem7781 PubChem CID: 2773278 IUPAC Name: [2-(bromomethyl)phenyl]boronic acid SMILES: OB(O)C1=CC=CC=C1CBr

PubChem CID 2773278
CAS 91983-14-1
Molecular Weight (g/mol) 214.85
MDL Number MFCD01318941
SMILES OB(O)C1=CC=CC=C1CBr
Synonym 2-bromomethylphenylboronic acid,2-bromomethyl benzeneboronic acid,2-bromomethyl phenylboronic acid,2-bromomethyl phenyl boronic acid,2-bromomethylphenylboronicacid,2-boronobenzyl bromide,o-boronobenzyl bromide,2-bromomethylphenyl boronic acid,pubchem7781
IUPAC Name [2-(bromomethyl)phenyl]boronic acid
InChI Key MYVJCOQGXCONPE-UHFFFAOYSA-N
Molecular Formula C7H8BBrO2
3,189

4-(Bromomethyl)benzeneboronic acid, tech. 85%

CAS: 68162-47-0 Molecular Formula: C7H8BBrO2 Molecular Weight (g/mol): 214.85 MDL Number: MFCD01318113 InChI Key: PDNOURKEZJZJNZ-UHFFFAOYSA-N Synonym: 4-bromomethyl phenylboronic acid,4-bromomethylphenylboronic acid,4-bromomethyl phenyl boronic acid,4-bromomethyl benzeneboronic acid,4-boronobenzyl bromide,p-bromomethyl phenylboronic acid,4-bromomethylphenyl boronic acid,4-bromomethylbenzeneboronic acid,boronic acid, 4-bromomethyl phenyl PubChem CID: 2735593 IUPAC Name: [4-(bromomethyl)phenyl]boronic acid SMILES: OB(O)C1=CC=C(CBr)C=C1

PubChem CID 2735593
CAS 68162-47-0
Molecular Weight (g/mol) 214.85
MDL Number MFCD01318113
SMILES OB(O)C1=CC=C(CBr)C=C1
Synonym 4-bromomethyl phenylboronic acid,4-bromomethylphenylboronic acid,4-bromomethyl phenyl boronic acid,4-bromomethyl benzeneboronic acid,4-boronobenzyl bromide,p-bromomethyl phenylboronic acid,4-bromomethylphenyl boronic acid,4-bromomethylbenzeneboronic acid,boronic acid, 4-bromomethyl phenyl
IUPAC Name [4-(bromomethyl)phenyl]boronic acid
InChI Key PDNOURKEZJZJNZ-UHFFFAOYSA-N
Molecular Formula C7H8BBrO2
3,190

Benzyl Alcohol, Technical, Spectrum™ Chemical
SDP

CAS: 100-51-6

CAS 100-51-6
3,191

(R)-(-)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetyl chloride, 98+%

CAS: 39637-99-5 Molecular Formula: C10H8ClF3O2 Molecular Weight (g/mol): 252.62 MDL Number: MFCD00044400 InChI Key: PAORVUMOXXAMPL-VIFPVBQESA-N Synonym: unii-81ut10uhv3,r---mtpa-cl,--alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,2r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,r---a-methoxy-a-trifluoromethylphenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,--mtpa-cl,--mosher's acid chloride PubChem CID: 3080792 IUPAC Name: (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride SMILES: CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F

PubChem CID 3080792
CAS 39637-99-5
Molecular Weight (g/mol) 252.62
MDL Number MFCD00044400
SMILES CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F
Synonym unii-81ut10uhv3,r---mtpa-cl,--alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,2r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,r---a-methoxy-a-trifluoromethylphenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,--mtpa-cl,--mosher's acid chloride
IUPAC Name (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride
InChI Key PAORVUMOXXAMPL-VIFPVBQESA-N
Molecular Formula C10H8ClF3O2
3,192

3-Hydroxybenzyl Alcohol, 97%

CAS: 620-24-6 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.14 MDL Number: MFCD00004643 InChI Key: OKVJCVWFVRATSG-UHFFFAOYSA-N Synonym: 3-hydroxybenzyl alcohol,3-hydroxymethyl phenol,benzenemethanol, 3-hydroxy,3-methylolphenol,m-hydroxybenzyl alcohol,3-hydroxybenzenemethanol,benzyl alcohol, m-hydroxy,3-hydroxybenzylalcohol,3-oh-benzyl-alcohol,3-hydroxymethyl-phenol PubChem CID: 102 ChEBI: CHEBI:17069 IUPAC Name: 3-(hydroxymethyl)phenol SMILES: C1=CC(=CC(=C1)O)CO

PubChem CID 102
CAS 620-24-6
Molecular Weight (g/mol) 124.14
ChEBI CHEBI:17069
MDL Number MFCD00004643
SMILES C1=CC(=CC(=C1)O)CO
Synonym 3-hydroxybenzyl alcohol,3-hydroxymethyl phenol,benzenemethanol, 3-hydroxy,3-methylolphenol,m-hydroxybenzyl alcohol,3-hydroxybenzenemethanol,benzyl alcohol, m-hydroxy,3-hydroxybenzylalcohol,3-oh-benzyl-alcohol,3-hydroxymethyl-phenol
IUPAC Name 3-(hydroxymethyl)phenol
InChI Key OKVJCVWFVRATSG-UHFFFAOYSA-N
Molecular Formula C7H8O2
3,193

4-(Chloromethyl)benzoic acid, 96%

CAS: 1642-81-5 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.592 MDL Number: MFCD00002568 InChI Key: OITNBJHJJGMFBN-UHFFFAOYSA-N Synonym: 4-chloromethyl benzoic acid,alpha-chloro-p-toluic acid,benzoic acid, 4-chloromethyl,4-carboxybenzyl chloride,4-chloromethyl-benzoic acid,alpha-chloro-p-toluylic acid,.alpha.-chloro-p-toluylic acid,pubchem15446,alpha-chloroparatoluic acid PubChem CID: 74234 IUPAC Name: 4-(chloromethyl)benzoic acid SMILES: C1=CC(=CC=C1CCl)C(=O)O

PubChem CID 74234
CAS 1642-81-5
Molecular Weight (g/mol) 170.592
MDL Number MFCD00002568
SMILES C1=CC(=CC=C1CCl)C(=O)O
Synonym 4-chloromethyl benzoic acid,alpha-chloro-p-toluic acid,benzoic acid, 4-chloromethyl,4-carboxybenzyl chloride,4-chloromethyl-benzoic acid,alpha-chloro-p-toluylic acid,.alpha.-chloro-p-toluylic acid,pubchem15446,alpha-chloroparatoluic acid
IUPAC Name 4-(chloromethyl)benzoic acid
InChI Key OITNBJHJJGMFBN-UHFFFAOYSA-N
Molecular Formula C8H7ClO2
3,194

1-Bromobenzyl methyl ether, 98%

CAS: 52711-30-5 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.06 MDL Number: MFCD03790887 InChI Key: QFAZLCRHLRJNAW-UHFFFAOYSA-N Synonym: 1-bromo-2-methoxymethyl benzene,2-bromobenzyl methyl ether,acmc-20ag76,methyl 2-bromobenzyl ether,1-methoxymethyl-2-bromobenzene,2-bromobenzyl alcohol, methyl ether,benzene,1-bromo-2-methoxymethyl PubChem CID: 12927162 IUPAC Name: 1-bromo-2-(methoxymethyl)benzene SMILES: COCC1=CC=CC=C1Br

PubChem CID 12927162
CAS 52711-30-5
Molecular Weight (g/mol) 201.06
MDL Number MFCD03790887
SMILES COCC1=CC=CC=C1Br
Synonym 1-bromo-2-methoxymethyl benzene,2-bromobenzyl methyl ether,acmc-20ag76,methyl 2-bromobenzyl ether,1-methoxymethyl-2-bromobenzene,2-bromobenzyl alcohol, methyl ether,benzene,1-bromo-2-methoxymethyl
IUPAC Name 1-bromo-2-(methoxymethyl)benzene
InChI Key QFAZLCRHLRJNAW-UHFFFAOYSA-N
Molecular Formula C8H9BrO
3,195

1,2-Phenylenediacetonitrile, 98%

CAS: 613-73-0 Molecular Formula: C10H8N2 Molecular Weight (g/mol): 156.19 MDL Number: MFCD00001905 InChI Key: FWPFXBANOKKNBR-UHFFFAOYSA-N Synonym: 1,2-phenylenediacetonitrile,o-phenylenediacetonitrile,1,2-bis cyanomethyl benzene,o-xylylene dicyanide,2-2-cyanomethyl phenyl acetonitrile,o-benzenediacetonitrile,2,2'-1,2-phenylene diacetonitrile,o-bis cyanomethyl benzene,1,2-benzenediacetonitrile,o-benzendiacetonitrile PubChem CID: 69180 IUPAC Name: 2-[2-(cyanomethyl)phenyl]acetonitrile SMILES: N#CCC1=CC=CC=C1CC#N

PubChem CID 69180
CAS 613-73-0
Molecular Weight (g/mol) 156.19
MDL Number MFCD00001905
SMILES N#CCC1=CC=CC=C1CC#N
Synonym 1,2-phenylenediacetonitrile,o-phenylenediacetonitrile,1,2-bis cyanomethyl benzene,o-xylylene dicyanide,2-2-cyanomethyl phenyl acetonitrile,o-benzenediacetonitrile,2,2'-1,2-phenylene diacetonitrile,o-bis cyanomethyl benzene,1,2-benzenediacetonitrile,o-benzendiacetonitrile
IUPAC Name 2-[2-(cyanomethyl)phenyl]acetonitrile
InChI Key FWPFXBANOKKNBR-UHFFFAOYSA-N
Molecular Formula C10H8N2