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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3,796 – 3,810 of 57,011 results

3,796

3-Fluorophenylacetonitrile, 99%

CAS: 501-00-8 Molecular Formula: C8H6FN Molecular Weight (g/mol): 135.141 MDL Number: MFCD00001907 InChI Key: DEJPYROXSVVWIE-UHFFFAOYSA-N Synonym: 3-fluorophenylacetonitrile,3-fluorobenzyl cyanide,2-3-fluorophenyl acetonitrile,m-fluorophenylacetonitrile,benzeneacetonitrile, 3-fluoro,3-fluorobenzeneacetonitrile,m-fluorobenzyl cyanide,acetonitrile, m-fluorophenyl,3-fluorophenyl acetonitrile,2-3-fluorophenyl ethanenitrile PubChem CID: 68145 IUPAC Name: 2-(3-fluorophenyl)acetonitrile SMILES: C1=CC(=CC(=C1)F)CC#N

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Specifications

PubChem CID	68145
CAS	501-00-8
Molecular Weight (g/mol)	135.141
MDL Number	MFCD00001907
SMILES	C1=CC(=CC(=C1)F)CC#N
Synonym	3-fluorophenylacetonitrile,3-fluorobenzyl cyanide,2-3-fluorophenyl acetonitrile,m-fluorophenylacetonitrile,benzeneacetonitrile, 3-fluoro,3-fluorobenzeneacetonitrile,m-fluorobenzyl cyanide,acetonitrile, m-fluorophenyl,3-fluorophenyl acetonitrile,2-3-fluorophenyl ethanenitrile
IUPAC Name	2-(3-fluorophenyl)acetonitrile
InChI Key	DEJPYROXSVVWIE-UHFFFAOYSA-N
Molecular Formula	C8H6FN

3,797

2,5-Dimethoxybenzyl alcohol, 99%

CAS: 33524-31-1 Molecular Formula: C₉H₁₂O₃ Molecular Weight (g/mol): 168.19 MDL Number: MFCD00004615 InChI Key: WGQMUABRZGUAOS-UHFFFAOYSA-N Synonym: 2,5-dimethoxybenzyl alcohol,2,5-dimethoxyphenyl methanol,benzenemethanol, 2,5-dimethoxy,acmc-1ckmt,2,5-dimethoxybenzylalcohol,2,5-dimethoxylbenzylalcohol,benzenemethanol,2,5-dimethoxy,2,5-dimethoxyphenyl-methanol,wgqmuabrzguaos-uhfffaoysa,2,5-dimethoxyphenyl methanol # PubChem CID: 118495 IUPAC Name: (2,5-dimethoxyphenyl)methanol SMILES: COC1=CC(=C(C=C1)OC)CO

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Specifications

PubChem CID	118495
CAS	33524-31-1
Molecular Weight (g/mol)	168.19
MDL Number	MFCD00004615
SMILES	COC1=CC(=C(C=C1)OC)CO
Synonym	2,5-dimethoxybenzyl alcohol,2,5-dimethoxyphenyl methanol,benzenemethanol, 2,5-dimethoxy,acmc-1ckmt,2,5-dimethoxybenzylalcohol,2,5-dimethoxylbenzylalcohol,benzenemethanol,2,5-dimethoxy,2,5-dimethoxyphenyl-methanol,wgqmuabrzguaos-uhfffaoysa,2,5-dimethoxyphenyl methanol #
IUPAC Name	(2,5-dimethoxyphenyl)methanol
InChI Key	WGQMUABRZGUAOS-UHFFFAOYSA-N
Molecular Formula	C₉H₁₂O₃

3,798

Benzyl Alcohol NF, Macron Fine Chemicals™

CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00004599,MFCD03792087 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonym: benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol PubChem CID: 244 ChEBI: CHEBI:17987 IUPAC Name: phenylmethanol SMILES: OCC1=CC=CC=C1

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Specifications

PubChem CID	244
CAS	100-51-6
Molecular Weight (g/mol)	108.14
ChEBI	CHEBI:17987
MDL Number	MFCD00004599,MFCD03792087
SMILES	OCC1=CC=CC=C1
Synonym	benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol
IUPAC Name	phenylmethanol
InChI Key	WVDDGKGOMKODPV-UHFFFAOYSA-N
Molecular Formula	C7H8O

3,799

2,5-Difluorobenzyl bromide, 98%

CAS: 85117-99-3 Molecular Formula: C7H5BrF2 Molecular Weight (g/mol): 207.02 MDL Number: MFCD00009897 InChI Key: ONWGSWNHQZYCFK-UHFFFAOYSA-N Synonym: 2,5-difluorobenzyl bromide,2-bromomethyl-1,4-difluorobenzene,2,5-difluorobenzylbromide,alpha-bromo-2,5-difluorotoluene,benzene, 2-bromomethyl-1,4-difluoro,timtec-bb sbb006680,2-bromomethyl-1,4-difluoro-benzene,pubchem10213,2,2-difluorobenzylbromide,acmc-209q4i PubChem CID: 522830 IUPAC Name: 2-(bromomethyl)-1,4-difluorobenzene SMILES: FC1=CC=C(F)C(CBr)=C1

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Specifications

PubChem CID	522830
CAS	85117-99-3
Molecular Weight (g/mol)	207.02
MDL Number	MFCD00009897
SMILES	FC1=CC=C(F)C(CBr)=C1
Synonym	2,5-difluorobenzyl bromide,2-bromomethyl-1,4-difluorobenzene,2,5-difluorobenzylbromide,alpha-bromo-2,5-difluorotoluene,benzene, 2-bromomethyl-1,4-difluoro,timtec-bb sbb006680,2-bromomethyl-1,4-difluoro-benzene,pubchem10213,2,2-difluorobenzylbromide,acmc-209q4i
IUPAC Name	2-(bromomethyl)-1,4-difluorobenzene
InChI Key	ONWGSWNHQZYCFK-UHFFFAOYSA-N
Molecular Formula	C7H5BrF2

3,800

(S)-(-)-2-Amino-3-benzyloxy-1-propanol, 98+%

CAS: 58577-88-1 Molecular Formula: C10H15NO2 Molecular Weight (g/mol): 181.235 MDL Number: MFCD04112477 InChI Key: ZJUOMDNENVWMPL-JTQLQIEISA-N Synonym: s-2-amino-3-benzyloxy-1-propanol,h-d-ser bzl-ol,2s-2-amino-3-benzyloxy propan-1-ol,s-2-amino-3-benzyloxy propan-1-ol,1-propanol, 2-amino-3-phenylmethoxy-, 2s,s---2-amino-3-benzyloxy-1-propanol, 98+%,ambotzhal1035,s---2-amino-3-benzyloxy-1-propal,s---2-amino-3-benzyloxy-1-propanol PubChem CID: 11401131 IUPAC Name: (2S)-2-amino-3-phenylmethoxypropan-1-ol SMILES: C1=CC=C(C=C1)COCC(CO)N

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Specifications

PubChem CID	11401131
CAS	58577-88-1
Molecular Weight (g/mol)	181.235
MDL Number	MFCD04112477
SMILES	C1=CC=C(C=C1)COCC(CO)N
Synonym	s-2-amino-3-benzyloxy-1-propanol,h-d-ser bzl-ol,2s-2-amino-3-benzyloxy propan-1-ol,s-2-amino-3-benzyloxy propan-1-ol,1-propanol, 2-amino-3-phenylmethoxy-, 2s,s---2-amino-3-benzyloxy-1-propanol, 98+%,ambotzhal1035,s---2-amino-3-benzyloxy-1-propal,s---2-amino-3-benzyloxy-1-propanol
IUPAC Name	(2S)-2-amino-3-phenylmethoxypropan-1-ol
InChI Key	ZJUOMDNENVWMPL-JTQLQIEISA-N
Molecular Formula	C10H15NO2

3,801

[3-(1H-Imidazol-1-ylmethyl)phenyl]methanol, ≥97%, Thermo Scientific™

CAS: 151055-79-7 Molecular Formula: C11H12N2O Molecular Weight (g/mol): 188.23 MDL Number: MFCD08271918 InChI Key: TXQZIKDWFOLTSC-UHFFFAOYSA-N PubChem CID: 10397593 IUPAC Name: [3-(imidazol-1-ylmethyl)phenyl]methanol SMILES: C1=CC(=CC(=C1)CO)CN2C=CN=C2

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Specifications

PubChem CID	10397593
CAS	151055-79-7
Molecular Weight (g/mol)	188.23
MDL Number	MFCD08271918
SMILES	C1=CC(=CC(=C1)CO)CN2C=CN=C2
IUPAC Name	[3-(imidazol-1-ylmethyl)phenyl]methanol
InChI Key	TXQZIKDWFOLTSC-UHFFFAOYSA-N
Molecular Formula	C11H12N2O

3,802

4-Vinylbenzyl chloride, 90%, technical

CAS: 1592-20-7 Molecular Formula: C9H9Cl Molecular Weight (g/mol): 152.62 MDL Number: MFCD00051362 InChI Key: ZRZHXNCATOYMJH-UHFFFAOYSA-N Synonym: 4-vinylbenzyl chloride,1-chloromethyl-4-vinylbenzene,4-chloromethylstyrene,4-vinylbenzylchloride,benzene, 1-chloromethyl-4-ethenyl,1-chloromethyl-4-ethenylbenzene,4-chloromethyl styrene,p-vinylbenzyl chloride,unii-cjl4oj6bs0,cjl4oj6bs0 PubChem CID: 74126 IUPAC Name: 1-(chloromethyl)-4-ethenylbenzene SMILES: ClCC1=CC=C(C=C)C=C1

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Specifications

PubChem CID	74126
CAS	1592-20-7
Molecular Weight (g/mol)	152.62
MDL Number	MFCD00051362
SMILES	ClCC1=CC=C(C=C)C=C1
Synonym	4-vinylbenzyl chloride,1-chloromethyl-4-vinylbenzene,4-chloromethylstyrene,4-vinylbenzylchloride,benzene, 1-chloromethyl-4-ethenyl,1-chloromethyl-4-ethenylbenzene,4-chloromethyl styrene,p-vinylbenzyl chloride,unii-cjl4oj6bs0,cjl4oj6bs0
IUPAC Name	1-(chloromethyl)-4-ethenylbenzene
InChI Key	ZRZHXNCATOYMJH-UHFFFAOYSA-N
Molecular Formula	C9H9Cl

3,803

2-Chloro-4-fluorobenzyl bromide, 97%

CAS: 45767-66-6 Molecular Formula: C7H5BrClF Molecular Weight (g/mol): 223.469 MDL Number: MFCD00236025 InChI Key: GAUUDQVOPUKGJD-UHFFFAOYSA-N Synonym: 2-chloro-4-fluorobenzyl bromide,1-bromomethyl-2-chloro-4-fluorobenzene,2-chloro-4-fluorobenzylbromide,alpha-bromo-2-chloro-4-fluorotoluene,benzene, 1-bromomethyl-2-chloro-4-fluoro,2-choro-4-fluorobenzylbromide,pubchem4893,1-bromomethyl-2-chloro-4-fluoro-benzene,ksc493m8r,2-chloro-4-flurobenzyl bromide PubChem CID: 2725062 IUPAC Name: 1-(bromomethyl)-2-chloro-4-fluorobenzene SMILES: C1=CC(=C(C=C1F)Cl)CBr

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Specifications

PubChem CID	2725062
CAS	45767-66-6
Molecular Weight (g/mol)	223.469
MDL Number	MFCD00236025
SMILES	C1=CC(=C(C=C1F)Cl)CBr
Synonym	2-chloro-4-fluorobenzyl bromide,1-bromomethyl-2-chloro-4-fluorobenzene,2-chloro-4-fluorobenzylbromide,alpha-bromo-2-chloro-4-fluorotoluene,benzene, 1-bromomethyl-2-chloro-4-fluoro,2-choro-4-fluorobenzylbromide,pubchem4893,1-bromomethyl-2-chloro-4-fluoro-benzene,ksc493m8r,2-chloro-4-flurobenzyl bromide
IUPAC Name	1-(bromomethyl)-2-chloro-4-fluorobenzene
InChI Key	GAUUDQVOPUKGJD-UHFFFAOYSA-N
Molecular Formula	C7H5BrClF

3,804

[2-(Tetrahydropyran-4-yloxy)phenyl]methanol, 97%, Thermo Scientific™

CAS: 478189-93-4 Molecular Formula: C12H16O3 Molecular Weight (g/mol): 208.257 MDL Number: MFCD09064960 InChI Key: RMRHXMQGVDIPCL-UHFFFAOYSA-N Synonym: 2-tetrahydropyran-4-yloxy phenyl methanol,2-oxan-4-yloxy phenyl methanol,2-oxan-4-yl oxy phenyl methanol,2-tetrahydro-2h-pyran-4-yloxy phenyl methanol,2-tetrahydro-2h-pyran-4-yl oxy phenyl methanol,2-2h-3,4,5,6-tetrahydropyran-4-yloxy phenyl methan-1-ol PubChem CID: 22932192 IUPAC Name: [2-(oxan-4-yloxy)phenyl]methanol SMILES: C1COCCC1OC2=CC=CC=C2CO

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Specifications

PubChem CID	22932192
CAS	478189-93-4
Molecular Weight (g/mol)	208.257
MDL Number	MFCD09064960
SMILES	C1COCCC1OC2=CC=CC=C2CO
Synonym	2-tetrahydropyran-4-yloxy phenyl methanol,2-oxan-4-yloxy phenyl methanol,2-oxan-4-yl oxy phenyl methanol,2-tetrahydro-2h-pyran-4-yloxy phenyl methanol,2-tetrahydro-2h-pyran-4-yl oxy phenyl methanol,2-2h-3,4,5,6-tetrahydropyran-4-yloxy phenyl methan-1-ol
IUPAC Name	[2-(oxan-4-yloxy)phenyl]methanol
InChI Key	RMRHXMQGVDIPCL-UHFFFAOYSA-N
Molecular Formula	C12H16O3

3,805

3,4,5-Trimethoxyphenylacetonitrile, 97%

CAS: 13338-63-1 Molecular Formula: C11H13NO3 Molecular Weight (g/mol): 207.23 MDL Number: MFCD00001912 InChI Key: ACFJNTXCEQCDBX-UHFFFAOYSA-N Synonym: 3,4,5-trimethoxyphenylacetonitrile,2-3,4,5-trimethoxyphenyl acetonitrile,3,4,5-trimethoxybenzyl cyanide,3,4,5-trimethoxybenzylnitrile,3,4,5-trimethoxybenzeneacetonitrile,benzeneacetonitrile, 3,4,5-trimethoxy,3,4,5-trimethoxyphenylacetylnitryl,3,4,5-trimethoxyphenyl acetonitrile,acetonitrile, 3,4,5-trimethoxyphenyl,2-3,4,5-trimethoxyphenyl ethanenitrile PubChem CID: 25887 IUPAC Name: 2-(3,4,5-trimethoxyphenyl)acetonitrile SMILES: COC1=CC(CC#N)=CC(OC)=C1OC

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Specifications

PubChem CID	25887
CAS	13338-63-1
Molecular Weight (g/mol)	207.23
MDL Number	MFCD00001912
SMILES	COC1=CC(CC#N)=CC(OC)=C1OC
Synonym	3,4,5-trimethoxyphenylacetonitrile,2-3,4,5-trimethoxyphenyl acetonitrile,3,4,5-trimethoxybenzyl cyanide,3,4,5-trimethoxybenzylnitrile,3,4,5-trimethoxybenzeneacetonitrile,benzeneacetonitrile, 3,4,5-trimethoxy,3,4,5-trimethoxyphenylacetylnitryl,3,4,5-trimethoxyphenyl acetonitrile,acetonitrile, 3,4,5-trimethoxyphenyl,2-3,4,5-trimethoxyphenyl ethanenitrile
IUPAC Name	2-(3,4,5-trimethoxyphenyl)acetonitrile
InChI Key	ACFJNTXCEQCDBX-UHFFFAOYSA-N
Molecular Formula	C11H13NO3

3,806

2-Benzyloxyethanol, 98%

CAS: 622-08-2 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00002868 InChI Key: CUZKCNWZBXLAJX-UHFFFAOYSA-N Synonym: 2-benzyloxy ethanol,2-benzyloxyethanol,ethanol, 2-phenylmethoxy,ethylene glycol monobenzyl ether,2-benzyloxy-1-ethanol,benzyl cellosolve,glycol benzyl ether,ethanol, 2-benzyloxy,glycol monobenzyl ether PubChem CID: 12141 IUPAC Name: 2-phenylmethoxyethanol SMILES: OCCOCC1=CC=CC=C1

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Specifications

PubChem CID	12141
CAS	622-08-2
Molecular Weight (g/mol)	152.19
MDL Number	MFCD00002868
SMILES	OCCOCC1=CC=CC=C1
Synonym	2-benzyloxy ethanol,2-benzyloxyethanol,ethanol, 2-phenylmethoxy,ethylene glycol monobenzyl ether,2-benzyloxy-1-ethanol,benzyl cellosolve,glycol benzyl ether,ethanol, 2-benzyloxy,glycol monobenzyl ether
IUPAC Name	2-phenylmethoxyethanol
InChI Key	CUZKCNWZBXLAJX-UHFFFAOYSA-N
Molecular Formula	C9H12O2

3,807

4-Fluoro-2-methylbenzyl alcohol, 99%

CAS: 80141-91-9 Molecular Formula: C8H9FO Molecular Weight (g/mol): 140.157 MDL Number: MFCD03701058 InChI Key: YSULUXOLTMBSFF-UHFFFAOYSA-N Synonym: 4-fluoro-2-methylphenyl methanol,4-fluoro-2-methylbenzyl alcohol,4-fluoro-2-methylbenzylalcohol,rarechem al bd 0506,4-fluoro-2-methylbenzenemethanol,benzenemethanol, 4-fluoro-2-methyl,4-fluoro-2-methyl-phenyl-methanol,4-fluoro-2-methylphenyl methan-1-ol,4'-fluoro-2-methylbenzyl alcohol PubChem CID: 3872017 IUPAC Name: (4-fluoro-2-methylphenyl)methanol SMILES: CC1=C(C=CC(=C1)F)CO

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Specifications

PubChem CID	3872017
CAS	80141-91-9
Molecular Weight (g/mol)	140.157
MDL Number	MFCD03701058
SMILES	CC1=C(C=CC(=C1)F)CO
Synonym	4-fluoro-2-methylphenyl methanol,4-fluoro-2-methylbenzyl alcohol,4-fluoro-2-methylbenzylalcohol,rarechem al bd 0506,4-fluoro-2-methylbenzenemethanol,benzenemethanol, 4-fluoro-2-methyl,4-fluoro-2-methyl-phenyl-methanol,4-fluoro-2-methylphenyl methan-1-ol,4'-fluoro-2-methylbenzyl alcohol
IUPAC Name	(4-fluoro-2-methylphenyl)methanol
InChI Key	YSULUXOLTMBSFF-UHFFFAOYSA-N
Molecular Formula	C8H9FO

3,808

4-Bromobenzaldehyde diethyl acetal, 98%, Thermo Scientific Chemicals

CAS: 34421-94-8 Molecular Formula: C11H15BrO2 Molecular Weight (g/mol): 259.14 MDL Number: MFCD01863514 InChI Key: BFSNEBVTOODGHZ-UHFFFAOYSA-N Synonym: 4-bromobenzaldehyde diethyl acetal,1-bromo-4-diethoxymethyl benzene,4-bromobenzaldehydediethylacetal,benzene, 1-bromo-4-diethoxymethyl,4-bromophenyl diethoxymethane,4-bromobenzaldehyde diethylacetal,4-bromo-alpha,alpha-diethoxytoluene,pubchem5372,acmc-1aigt,4-bromobenzaldehydediethyl acetal PubChem CID: 688340 IUPAC Name: 1-bromo-4-(diethoxymethyl)benzene SMILES: CCOC(OCC)C1=CC=C(Br)C=C1

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Specifications

PubChem CID	688340
CAS	34421-94-8
Molecular Weight (g/mol)	259.14
MDL Number	MFCD01863514
SMILES	CCOC(OCC)C1=CC=C(Br)C=C1
Synonym	4-bromobenzaldehyde diethyl acetal,1-bromo-4-diethoxymethyl benzene,4-bromobenzaldehydediethylacetal,benzene, 1-bromo-4-diethoxymethyl,4-bromophenyl diethoxymethane,4-bromobenzaldehyde diethylacetal,4-bromo-alpha,alpha-diethoxytoluene,pubchem5372,acmc-1aigt,4-bromobenzaldehydediethyl acetal
IUPAC Name	1-bromo-4-(diethoxymethyl)benzene
InChI Key	BFSNEBVTOODGHZ-UHFFFAOYSA-N
Molecular Formula	C11H15BrO2

3,809

4-Bromobenzaldehyde diethyl acetal, 99%, Thermo Scientific™

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Specifications

PubChem CID	688340
CAS	34421-94-8
Molecular Weight (g/mol)	259.14
MDL Number	MFCD01863514
SMILES	CCOC(OCC)C1=CC=C(Br)C=C1
Synonym	4-bromobenzaldehyde diethyl acetal,1-bromo-4-diethoxymethyl benzene,4-bromobenzaldehydediethylacetal,benzene, 1-bromo-4-diethoxymethyl,4-bromophenyl diethoxymethane,4-bromobenzaldehyde diethylacetal,4-bromo-alpha,alpha-diethoxytoluene,pubchem5372,acmc-1aigt,4-bromobenzaldehydediethyl acetal
IUPAC Name	1-bromo-4-(diethoxymethyl)benzene
InChI Key	BFSNEBVTOODGHZ-UHFFFAOYSA-N
Molecular Formula	C11H15BrO2

3,810

Miconazole, USP, 98-102%, Spectrum™ Chemical

CAS: 22916-47-8 Molecular Formula: C18H14Cl4N2O Molecular Weight (g/mol): 416.12 MDL Number: MFCD00216019 InChI Key: BYBLEWFAAKGYCD-UHFFFAOYNA-N IUPAC Name: 1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]-1H-imidazole SMILES: ClC1=CC=C(COC(CN2C=CN=C2)C2=CC=C(Cl)C=C2Cl)C(Cl)=C1

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Specifications

CAS	22916-47-8
Molecular Weight (g/mol)	416.12
MDL Number	MFCD00216019
SMILES	ClC1=CC=C(COC(CN2C=CN=C2)C2=CC=C(Cl)C=C2Cl)C(Cl)=C1
IUPAC Name	1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]-1H-imidazole
InChI Key	BYBLEWFAAKGYCD-UHFFFAOYNA-N
Molecular Formula	C18H14Cl4N2O

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Miconazole, USP, 98-102%, Spectrum™ Chemical