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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2,251 – 2,265 of 57,280 results

2,251

Benzyl alcohol, specified according to requirements of Ph.Eur.

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

2,252

4-Methoxyphenylacetonitrile, 98%

CAS: 104-47-2 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 MDL Number: MFCD00001919 InChI Key: PACGLQCRGWFBJH-UHFFFAOYSA-N Synonym: 4-methoxyphenylacetonitrile,2-4-methoxyphenyl acetonitrile,4-methoxybenzyl cyanide,4-methoxyphenyl acetonitrile,p-methoxyphenylacetonitrile,benzeneacetonitrile, 4-methoxy,p-methoxybenzyl cyanide,anisylacetonitrile,4-anisyl cyanide,p-methoxybenzeneacetonitrile PubChem CID: 66031 IUPAC Name: 2-(4-methoxyphenyl)acetonitrile SMILES: COC1=CC=C(C=C1)CC#N

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PubChem CID	66031
CAS	104-47-2
Molecular Weight (g/mol)	147.177
MDL Number	MFCD00001919
SMILES	COC1=CC=C(C=C1)CC#N
Synonym	4-methoxyphenylacetonitrile,2-4-methoxyphenyl acetonitrile,4-methoxybenzyl cyanide,4-methoxyphenyl acetonitrile,p-methoxyphenylacetonitrile,benzeneacetonitrile, 4-methoxy,p-methoxybenzyl cyanide,anisylacetonitrile,4-anisyl cyanide,p-methoxybenzeneacetonitrile
IUPAC Name	2-(4-methoxyphenyl)acetonitrile
InChI Key	PACGLQCRGWFBJH-UHFFFAOYSA-N
Molecular Formula	C9H9NO

2,253

[2-(Phenoxymethyl)phenyl]methanol, 97%, Thermo Scientific™

CAS: 34904-98-8 Molecular Formula: C14H14O2 Molecular Weight (g/mol): 214.264 MDL Number: MFCD08690312 InChI Key: RMRTWBZKENSMCI-UHFFFAOYSA-N Synonym: 2-phenoxymethyl phenyl methanol,benzenemethanol,2-phenoxymethyl,2-phenoxymethyl phenyl methan-1-ol PubChem CID: 22932170 IUPAC Name: [2-(phenoxymethyl)phenyl]methanol SMILES: C1=CC=C(C=C1)OCC2=CC=CC=C2CO

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Specifications

PubChem CID	22932170
CAS	34904-98-8
Molecular Weight (g/mol)	214.264
MDL Number	MFCD08690312
SMILES	C1=CC=C(C=C1)OCC2=CC=CC=C2CO
Synonym	2-phenoxymethyl phenyl methanol,benzenemethanol,2-phenoxymethyl,2-phenoxymethyl phenyl methan-1-ol
IUPAC Name	[2-(phenoxymethyl)phenyl]methanol
InChI Key	RMRTWBZKENSMCI-UHFFFAOYSA-N
Molecular Formula	C14H14O2

2,254

3,4-Dichlorobenzyl chloride, 98+%

CAS: 102-47-6 Molecular Formula: C₇H₅Cl₃ Molecular Weight (g/mol): 195.47 MDL Number: MFCD00000906 InChI Key: YZIFVWOCPGPNHB-UHFFFAOYSA-N Synonym: 3,4-dichlorobenzyl chloride,1,2-dichloro-4-chloromethyl benzene,alpha,3,4-trichlorotoluene,benzene, 1,2-dichloro-4-chloromethyl,unii-451pb8smie,1,2-dichloro-4-chloromethyl-benzene,3,4-dichlorobenzylchloride,451pb8smie,3,4-dichlorophenylmethyl chloride,toluene, .alpha.,3,4-trichloro PubChem CID: 7609 IUPAC Name: 1,2-dichloro-4-(chloromethyl)benzene SMILES: C1=CC(=C(C=C1CCl)Cl)Cl

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Specifications

PubChem CID	7609
CAS	102-47-6
Molecular Weight (g/mol)	195.47
MDL Number	MFCD00000906
SMILES	C1=CC(=C(C=C1CCl)Cl)Cl
Synonym	3,4-dichlorobenzyl chloride,1,2-dichloro-4-chloromethyl benzene,alpha,3,4-trichlorotoluene,benzene, 1,2-dichloro-4-chloromethyl,unii-451pb8smie,1,2-dichloro-4-chloromethyl-benzene,3,4-dichlorobenzylchloride,451pb8smie,3,4-dichlorophenylmethyl chloride,toluene, .alpha.,3,4-trichloro
IUPAC Name	1,2-dichloro-4-(chloromethyl)benzene
InChI Key	YZIFVWOCPGPNHB-UHFFFAOYSA-N
Molecular Formula	C₇H₅Cl₃

2,255

Econazole nitrate

CAS: 24169-02-6 Molecular Formula: C18H16Cl3N3O4 Molecular Weight (g/mol): 444.693 MDL Number: MFCD00058160 InChI Key: DDXORDQKGIZAME-UHFFFAOYSA-N Synonym: econazole nitrate,ifenec,epi-pevaryl,gyno-pevaryl,econazole nitrate salt,pevaryl,+--econazole nitrate,spectazole,econazolum nitrate,gyno-pevaryl 150 PubChem CID: 68589 IUPAC Name: 1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole;nitric acid SMILES: C1=CC(=CC=C1COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)Cl.[N+](=O)(O)[O-]

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Specifications

PubChem CID	68589
CAS	24169-02-6
Molecular Weight (g/mol)	444.693
MDL Number	MFCD00058160
SMILES	C1=CC(=CC=C1COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)Cl.[N+](=O)(O)[O-]
Synonym	econazole nitrate,ifenec,epi-pevaryl,gyno-pevaryl,econazole nitrate salt,pevaryl,+--econazole nitrate,spectazole,econazolum nitrate,gyno-pevaryl 150
IUPAC Name	1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole;nitric acid
InChI Key	DDXORDQKGIZAME-UHFFFAOYSA-N
Molecular Formula	C18H16Cl3N3O4

2,256

o-Xylylene dibromide, 97%

CAS: 91-13-4 Molecular Formula: C8H8Br2 Molecular Weight (g/mol): 263.96 MDL Number: MFCD00000175 InChI Key: KGKAYWMGPDWLQZ-UHFFFAOYSA-N Synonym: 1,2-bis bromomethyl benzene,o-xylylene dibromide,alpha,alpha'-dibromo-o-xylene,benzene, 1,2-bis bromomethyl,o-bis bromomethyl benzene,o-xylylene bromide,1,2-dibenzyl bromide,alpha,alpha'-dibromo-o-xylol,a,a'-dibromo-o-xylene,ccris 1776 PubChem CID: 66665 IUPAC Name: 1,2-bis(bromomethyl)benzene SMILES: C1=CC=C(C(=C1)CBr)CBr

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Specifications

PubChem CID	66665
CAS	91-13-4
Molecular Weight (g/mol)	263.96
MDL Number	MFCD00000175
SMILES	C1=CC=C(C(=C1)CBr)CBr
Synonym	1,2-bis bromomethyl benzene,o-xylylene dibromide,alpha,alpha'-dibromo-o-xylene,benzene, 1,2-bis bromomethyl,o-bis bromomethyl benzene,o-xylylene bromide,1,2-dibenzyl bromide,alpha,alpha'-dibromo-o-xylol,a,a'-dibromo-o-xylene,ccris 1776
IUPAC Name	1,2-bis(bromomethyl)benzene
InChI Key	KGKAYWMGPDWLQZ-UHFFFAOYSA-N
Molecular Formula	C8H8Br2

2,257

Benzyloxyacetaldehyde, 95%, stabilized

CAS: 60656-87-3 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00191779 InChI Key: NFNOAHXEQXMCGT-UHFFFAOYSA-N Synonym: 2-benzyloxy acetaldehyde,benzyloxyacetaldehyde,benzyloxy acetaldehyde,phenylmethoxy acetaldehyde,acetaldehyde, phenylmethoxy,acetaldehyde,2-phenylmethoxy,acmc-20ahpl,benzyloxy-acetaldehyde,2-phenylmethoxyethanal PubChem CID: 108989 SMILES: O=CCOCC1=CC=CC=C1

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PubChem CID	108989
CAS	60656-87-3
Molecular Weight (g/mol)	150.18
MDL Number	MFCD00191779
SMILES	O=CCOCC1=CC=CC=C1
Synonym	2-benzyloxy acetaldehyde,benzyloxyacetaldehyde,benzyloxy acetaldehyde,phenylmethoxy acetaldehyde,acetaldehyde, phenylmethoxy,acetaldehyde,2-phenylmethoxy,acmc-20ahpl,benzyloxy-acetaldehyde,2-phenylmethoxyethanal
InChI Key	NFNOAHXEQXMCGT-UHFFFAOYSA-N
Molecular Formula	C9H10O2

2,258

Methyl 3-(bromomethyl)benzoate, 97%

CAS: 1129-28-8 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00051437 InChI Key: YUHSMQQNPRLEEJ-UHFFFAOYSA-N PubChem CID: 517981 IUPAC Name: methyl 3-(bromomethyl)benzoate SMILES: COC(=O)C1=CC=CC(CBr)=C1

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PubChem CID	517981
CAS	1129-28-8
Molecular Weight (g/mol)	229.07
MDL Number	MFCD00051437
SMILES	COC(=O)C1=CC=CC(CBr)=C1
IUPAC Name	methyl 3-(bromomethyl)benzoate
InChI Key	YUHSMQQNPRLEEJ-UHFFFAOYSA-N
Molecular Formula	C9H9BrO2

2,259

5-[4-(Bromomethyl)phenyl]-3-methyl-1,2,4-oxadiazole, 95%, Thermo Scientific™

CAS: 362529-03-1 Molecular Formula: C10H9BrN2O Molecular Weight (g/mol): 253.099 MDL Number: MFCD09025866 InChI Key: RWTXHMRWDVQEOV-UHFFFAOYSA-N Synonym: 5-4-bromomethyl phenyl-3-methyl-1,2,4-oxadiazole,1,2,4-oxadiazole, 5-4-bromomethyl phenyl-3-methyl,1,2,4-oxadiazole,5-4-bromomethyl phenyl-3-methyl PubChem CID: 18374480 IUPAC Name: 5-[4-(bromomethyl)phenyl]-3-methyl-1,2,4-oxadiazole SMILES: CC1=NOC(=N1)C2=CC=C(C=C2)CBr

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Specifications

PubChem CID	18374480
CAS	362529-03-1
Molecular Weight (g/mol)	253.099
MDL Number	MFCD09025866
SMILES	CC1=NOC(=N1)C2=CC=C(C=C2)CBr
Synonym	5-4-bromomethyl phenyl-3-methyl-1,2,4-oxadiazole,1,2,4-oxadiazole, 5-4-bromomethyl phenyl-3-methyl,1,2,4-oxadiazole,5-4-bromomethyl phenyl-3-methyl
IUPAC Name	5-[4-(bromomethyl)phenyl]-3-methyl-1,2,4-oxadiazole
InChI Key	RWTXHMRWDVQEOV-UHFFFAOYSA-N
Molecular Formula	C10H9BrN2O

2,260

alpha,alpha'-Dichloro-p-xylene, 98%

CAS: 623-25-6 MDL Number: MFCD00000920 InChI Key: ZZHIDJWUJRKHGX-UHFFFAOYSA-N Synonym: 1,4-bis chloromethyl benzene,alpha,alpha'-dichloro-p-xylene,p-xylylene dichloride,p-xylylene chloride,benzene, 1,4-bis chloromethyl,p-bis chloromethyl benzene,benzene, p-bis chloromethyl,a,a'-dichloro-p-xylene,xylylene dichloride,ccris 1772 PubChem CID: 12171 IUPAC Name: 1,4-bis(chloromethyl)benzene SMILES: C1=CC(=CC=C1CCl)CCl

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PubChem CID	12171
CAS	623-25-6
MDL Number	MFCD00000920
SMILES	C1=CC(=CC=C1CCl)CCl
Synonym	1,4-bis chloromethyl benzene,alpha,alpha'-dichloro-p-xylene,p-xylylene dichloride,p-xylylene chloride,benzene, 1,4-bis chloromethyl,p-bis chloromethyl benzene,benzene, p-bis chloromethyl,a,a'-dichloro-p-xylene,xylylene dichloride,ccris 1772
IUPAC Name	1,4-bis(chloromethyl)benzene
InChI Key	ZZHIDJWUJRKHGX-UHFFFAOYSA-N

2,261

4-Hydroxybenzyl alcohol, 97%

CAS: 623-05-2 Molecular Formula: C₇H₈O₂ Molecular Weight (g/mol): 124.14 InChI Key: BVJSUAQZOZWCKN-UHFFFAOYSA-N Synonym: 4-hydroxybenzyl alcohol,4-hydroxymethyl phenol,p-hydroxybenzyl alcohol,p-methylolphenol,4-methylolphenol,4-hydroxybenzenemethanol,benzenemethanol, 4-hydroxy,p-hydroxymethyl phenol,gastrodigenin,4-hydroxybenzylalcohol PubChem CID: 125 ChEBI: CHEBI:67410 IUPAC Name: 4-(hydroxymethyl)phenol SMILES: C1=CC(=CC=C1CO)O

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Specifications

PubChem CID	125
CAS	623-05-2
Molecular Weight (g/mol)	124.14
ChEBI	CHEBI:67410
SMILES	C1=CC(=CC=C1CO)O
Synonym	4-hydroxybenzyl alcohol,4-hydroxymethyl phenol,p-hydroxybenzyl alcohol,p-methylolphenol,4-methylolphenol,4-hydroxybenzenemethanol,benzenemethanol, 4-hydroxy,p-hydroxymethyl phenol,gastrodigenin,4-hydroxybenzylalcohol
IUPAC Name	4-(hydroxymethyl)phenol
InChI Key	BVJSUAQZOZWCKN-UHFFFAOYSA-N
Molecular Formula	C₇H₈O₂

2,262

2-Aminobenzyl alcohol, 98%

CAS: 5344-90-1 Molecular Formula: C₇H₉NO Molecular Weight (g/mol): 123.15 MDL Number: MFCD00007749 InChI Key: VYFOAVADNIHPTR-UHFFFAOYSA-N Synonym: 2-aminobenzyl alcohol,2-aminophenyl methanol,2-aminobenzylalcohol,o-aminobenzyl alcohol,2-aminobenzenemethanol,benzenemethanol, 2-amino,o-aminobenzylic alcohol,o-hydroxymethyl aniline,benzyl alcohol, o-amino,2-hydroxymethylaniline PubChem CID: 21439 IUPAC Name: (2-aminophenyl)methanol SMILES: C1=CC=C(C(=C1)CO)N

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Specifications

PubChem CID	21439
CAS	5344-90-1
Molecular Weight (g/mol)	123.15
MDL Number	MFCD00007749
SMILES	C1=CC=C(C(=C1)CO)N
Synonym	2-aminobenzyl alcohol,2-aminophenyl methanol,2-aminobenzylalcohol,o-aminobenzyl alcohol,2-aminobenzenemethanol,benzenemethanol, 2-amino,o-aminobenzylic alcohol,o-hydroxymethyl aniline,benzyl alcohol, o-amino,2-hydroxymethylaniline
IUPAC Name	(2-aminophenyl)methanol
InChI Key	VYFOAVADNIHPTR-UHFFFAOYSA-N
Molecular Formula	C₇H₉NO

2,263

3,4,5-Trifluorobenzyl bromide, 97%

CAS: 220141-72-0 Molecular Formula: C7H4BrF3 Molecular Weight (g/mol): 225.01 MDL Number: MFCD00083528 InChI Key: MPEKZIYOLQCWLL-UHFFFAOYSA-N Synonym: 3,4,5-trifluorobenzyl bromide,5-bromomethyl-1,2,3-trifluorobenzene,3,4,5-trifluorobenzylbromide,alpha-bromo-3,4,5-trifluorotoluene,3,4,5-trifluoro benzyl bromide,benzene, 5-bromomethyl-1,2,3-trifluoro,a-bromo-3,4,5-trifluorotoluene,pubchem4670,acmc-1cupe PubChem CID: 2777062 IUPAC Name: 5-(bromomethyl)-1,2,3-trifluorobenzene SMILES: FC1=CC(CBr)=CC(F)=C1F

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Specifications

PubChem CID	2777062
CAS	220141-72-0
Molecular Weight (g/mol)	225.01
MDL Number	MFCD00083528
SMILES	FC1=CC(CBr)=CC(F)=C1F
Synonym	3,4,5-trifluorobenzyl bromide,5-bromomethyl-1,2,3-trifluorobenzene,3,4,5-trifluorobenzylbromide,alpha-bromo-3,4,5-trifluorotoluene,3,4,5-trifluoro benzyl bromide,benzene, 5-bromomethyl-1,2,3-trifluoro,a-bromo-3,4,5-trifluorotoluene,pubchem4670,acmc-1cupe
IUPAC Name	5-(bromomethyl)-1,2,3-trifluorobenzene
InChI Key	MPEKZIYOLQCWLL-UHFFFAOYSA-N
Molecular Formula	C7H4BrF3

2,264

2-Bromo-5-fluorobenzyl bromide, 97%

CAS: 112399-50-5 Molecular Formula: C7H5Br2F Molecular Weight (g/mol): 267.923 MDL Number: MFCD00042187 InChI Key: CZLWYKAZAVYQIK-UHFFFAOYSA-N Synonym: 2-bromo-5-fluorobenzyl bromide,1-bromo-2-bromomethyl-4-fluorobenzene,5-fluoro-2-bromobenzyl bromide,2-bromo-5-fluorobenzylbromide,benzene, 1-bromo-2-bromomethyl-4-fluoro,alpha,2-dibromo-5-fluorotoluene,pubchem1953,acmc-1bt22,ksc493i2h,2-bromo-5-fluoro benzyl bromide PubChem CID: 517972 IUPAC Name: 1-bromo-2-(bromomethyl)-4-fluorobenzene SMILES: C1=CC(=C(C=C1F)CBr)Br

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Specifications

PubChem CID	517972
CAS	112399-50-5
Molecular Weight (g/mol)	267.923
MDL Number	MFCD00042187
SMILES	C1=CC(=C(C=C1F)CBr)Br
Synonym	2-bromo-5-fluorobenzyl bromide,1-bromo-2-bromomethyl-4-fluorobenzene,5-fluoro-2-bromobenzyl bromide,2-bromo-5-fluorobenzylbromide,benzene, 1-bromo-2-bromomethyl-4-fluoro,alpha,2-dibromo-5-fluorotoluene,pubchem1953,acmc-1bt22,ksc493i2h,2-bromo-5-fluoro benzyl bromide
IUPAC Name	1-bromo-2-(bromomethyl)-4-fluorobenzene
InChI Key	CZLWYKAZAVYQIK-UHFFFAOYSA-N
Molecular Formula	C7H5Br2F

2,265

N-BOC-O-Benzyl-D-serine, 98%

CAS: 47173-80-8 Molecular Formula: C15H20NO5 Molecular Weight (g/mol): 294.33 MDL Number: MFCD00038248 InChI Key: DMBKPDOAQVGTST-GFCCVEGCSA-M Synonym: n-boc-o-benzyl-d-serine,boc-d-ser bzl-oh,boc-o-benzyl-d-serine,o-benzyl-n-tert-butoxycarbonyl-d-serine,d-serine, n-1,1-dimethylethoxy carbonyl-o-phenylmethyl,2r-3-benzyloxy-2-tert-butoxycarbonyl amino propanoic acid,2r-3-benzyl-oxy-2-tert-butoxy carbonyl amino propanoic acid,pubchem12444,pubchem14944,boc-d-ser obn-oh PubChem CID: 2733693 SMILES: CC(C)(C)OC(=O)N[C@H](COCC1=CC=CC=C1)C([O-])=O

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Specifications

PubChem CID	2733693
CAS	47173-80-8
Molecular Weight (g/mol)	294.33
MDL Number	MFCD00038248
SMILES	CC(C)(C)OC(=O)N[C@H](COCC1=CC=CC=C1)C([O-])=O
Synonym	n-boc-o-benzyl-d-serine,boc-d-ser bzl-oh,boc-o-benzyl-d-serine,o-benzyl-n-tert-butoxycarbonyl-d-serine,d-serine, n-1,1-dimethylethoxy carbonyl-o-phenylmethyl,2r-3-benzyloxy-2-tert-butoxycarbonyl amino propanoic acid,2r-3-benzyl-oxy-2-tert-butoxy carbonyl amino propanoic acid,pubchem12444,pubchem14944,boc-d-ser obn-oh
InChI Key	DMBKPDOAQVGTST-GFCCVEGCSA-M
Molecular Formula	C15H20NO5

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