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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 (130,195)
Phenols (25,097)
Naphthalenes (6,365)
Phenol esters (4,813)
Unsubstituted Phenols (1,453)
Fluorenes (1,295)
Thiophenols (762)
Anthracenes (515)
Indanes (488)
Phenanthrenes and derivatives (364)
Tetralins (337)
Triphenyl compounds (278)
Pyrenes (276)
Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (16)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (6)

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6,316 – 6,330 of 159,118 results
6,316

4-Bromobenzaldehyde Diethyl Acetal 97.0+%, TCI America™

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

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
6,317

3,5-Dinitrobenzotrifluoride 98.0+%, TCI America™

CAS: 401-99-0 Molecular Formula: C7H3F3N2O4 Molecular Weight (g/mol): 236.106 MDL Number: MFCD00007233 InChI Key: QZADIXWDDVQVKM-UHFFFAOYSA-N PubChem CID: 123060 IUPAC Name: 1,3-dinitro-5-(trifluoromethyl)benzene SMILES: C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(F)(F)F

PubChem CID 123060
CAS 401-99-0
Molecular Weight (g/mol) 236.106
MDL Number MFCD00007233
SMILES C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(F)(F)F
IUPAC Name 1,3-dinitro-5-(trifluoromethyl)benzene
InChI Key QZADIXWDDVQVKM-UHFFFAOYSA-N
Molecular Formula C7H3F3N2O4
6,318

2-(Trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™

PubChem CID 2734387
CAS 1423-27-4
Molecular Weight (g/mol) 189.928
MDL Number MFCD00236059
Color White-Yellow
Physical Form Crystalline Powder
SMILES B(C1=CC=CC=C1C(F)(F)F)(O)O
Synonym 2-trifluoromethyl phenylboronic acid,2-trifluoromethylphenylboronic acid,2-trifluoromethyl phenyl boronic acid,2-trifluoromethyl benzeneboronic acid,2-trifluoromethyl phenyl boranediol
TSCA No
IUPAC Name [2-(trifluoromethyl)phenyl]boronic acid
InChI Key JNSBEPKGFVENFS-UHFFFAOYSA-N
Molecular Formula C7H6BF3O2
Formula Weight 189.93
6,319

2-Bromo-5-(trifluoromethyl)benzaldehyde 97.0+%, TCI America™

CAS: 102684-91-3 Molecular Formula: C8H4BrF3O Molecular Weight (g/mol): 253.02 MDL Number: MFCD04973760 InChI Key: CSOBJYGHQOLWOD-UHFFFAOYSA-N Synonym: 2-bromo-5-trifluoromethyl benzaldehyde,4-bromo-3-formylbenzotrifluoride,2-bromo-5-1,1-dimethylethyl-benzaldehyde,benzaldehyde, 2-bromo-5-1,1-dimethylethyl,benzaldehyde, 2-bromo-5-trifluoromethyl,paragos 530289,pubchem1428,pubchem4179,ksc498c1d,bromo 5-trifluoromethyl benzaldehyde PubChem CID: 7018047 IUPAC Name: 2-bromo-5-(trifluoromethyl)benzaldehyde SMILES: FC(F)(F)C1=CC(C=O)=C(Br)C=C1

PubChem CID 7018047
CAS 102684-91-3
Molecular Weight (g/mol) 253.02
MDL Number MFCD04973760
SMILES FC(F)(F)C1=CC(C=O)=C(Br)C=C1
Synonym 2-bromo-5-trifluoromethyl benzaldehyde,4-bromo-3-formylbenzotrifluoride,2-bromo-5-1,1-dimethylethyl-benzaldehyde,benzaldehyde, 2-bromo-5-1,1-dimethylethyl,benzaldehyde, 2-bromo-5-trifluoromethyl,paragos 530289,pubchem1428,pubchem4179,ksc498c1d,bromo 5-trifluoromethyl benzaldehyde
IUPAC Name 2-bromo-5-(trifluoromethyl)benzaldehyde
InChI Key CSOBJYGHQOLWOD-UHFFFAOYSA-N
Molecular Formula C8H4BrF3O
6,320

3-Methylbenzyl Alcohol 98.0+%, TCI America™

CAS: 587-03-1 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.167 MDL Number: MFCD00004646 InChI Key: JJCKHVUTVOPLBV-UHFFFAOYSA-N Synonym: 3-methylbenzyl alcohol,3-methylphenyl methanol,m-tolyl carbinol,m-tolylmethanol,benzenemethanol, 3-methyl,unii-ttg38p37u6,m-methylbenzyl alcohol,3-methylbenzylalcohol,m-methyl benzyl alcohol,3-methyl-benzenemethanol PubChem CID: 11476 ChEBI: CHEBI:27995 IUPAC Name: (3-methylphenyl)methanol SMILES: CC1=CC(=CC=C1)CO

PubChem CID 11476
CAS 587-03-1
Molecular Weight (g/mol) 122.167
ChEBI CHEBI:27995
MDL Number MFCD00004646
SMILES CC1=CC(=CC=C1)CO
Synonym 3-methylbenzyl alcohol,3-methylphenyl methanol,m-tolyl carbinol,m-tolylmethanol,benzenemethanol, 3-methyl,unii-ttg38p37u6,m-methylbenzyl alcohol,3-methylbenzylalcohol,m-methyl benzyl alcohol,3-methyl-benzenemethanol
IUPAC Name (3-methylphenyl)methanol
InChI Key JJCKHVUTVOPLBV-UHFFFAOYSA-N
Molecular Formula C8H10O
6,321

DL-alpha-Methoxyphenylacetic Acid 98.0+%, TCI America™

CAS: 7021-09-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00064217 InChI Key: DIWVBIXQCNRCFE-UHFFFAOYNA-N Synonym: methoxyphenylacetic acid,methoxy phenyl acetic acid,dl-alpha-methoxyphenylacetic acid,acetic acid, methoxyphenyl,alpha-methoxyphenylacetic acid,o-methyl-dl-mandelic acid,benzeneacetic acid, .alpha.-methoxy,2-methoxy-2-phenyl-acetic acid,methyloxy phenyl acetic acid,.alpha.-methoxyphenylacetic acid PubChem CID: 107202 IUPAC Name: 2-methoxy-2-phenylacetic acid SMILES: COC(C1=CC=CC=C1)C(=O)O

PubChem CID 107202
CAS 7021-09-2
Molecular Weight (g/mol) 166.18
MDL Number MFCD00064217
SMILES COC(C1=CC=CC=C1)C(=O)O
Synonym methoxyphenylacetic acid,methoxy phenyl acetic acid,dl-alpha-methoxyphenylacetic acid,acetic acid, methoxyphenyl,alpha-methoxyphenylacetic acid,o-methyl-dl-mandelic acid,benzeneacetic acid, .alpha.-methoxy,2-methoxy-2-phenyl-acetic acid,methyloxy phenyl acetic acid,.alpha.-methoxyphenylacetic acid
IUPAC Name 2-methoxy-2-phenylacetic acid
InChI Key DIWVBIXQCNRCFE-UHFFFAOYNA-N
Molecular Formula C9H10O3
6,322

2,4-Dichlorobenzyl Alcohol 97.0+%, TCI America™

CAS: 1777-82-8 Molecular Formula: C7H6Cl2O Molecular Weight (g/mol): 177.024 MDL Number: MFCD00004606 InChI Key: DBHODFSFBXJZNY-UHFFFAOYSA-N Synonym: 2,4-dichlorobenzyl alcohol,2,4-dichlorophenyl methanol,dybenal,2,4-dichlorobenzenemethanol,rapidosept,myacide sp,benzenemethanol, 2,4-dichloro,benzyl alcohol, 2,4-dichloro,unii-1nkx3648j9,2,4-dichlorobenzylalcohol PubChem CID: 15684 ChEBI: CHEBI:48220 IUPAC Name: (2,4-dichlorophenyl)methanol SMILES: C1=CC(=C(C=C1Cl)Cl)CO

PubChem CID 15684
CAS 1777-82-8
Molecular Weight (g/mol) 177.024
ChEBI CHEBI:48220
MDL Number MFCD00004606
SMILES C1=CC(=C(C=C1Cl)Cl)CO
Synonym 2,4-dichlorobenzyl alcohol,2,4-dichlorophenyl methanol,dybenal,2,4-dichlorobenzenemethanol,rapidosept,myacide sp,benzenemethanol, 2,4-dichloro,benzyl alcohol, 2,4-dichloro,unii-1nkx3648j9,2,4-dichlorobenzylalcohol
IUPAC Name (2,4-dichlorophenyl)methanol
InChI Key DBHODFSFBXJZNY-UHFFFAOYSA-N
Molecular Formula C7H6Cl2O
6,323

4-Chlorobenzyl Chloride 98.0+%, TCI America™

CAS: 104-83-6 Molecular Formula: C7H6Cl2 Molecular Weight (g/mol): 161.025 MDL Number: MFCD00000914 InChI Key: JQZAEUFPPSRDOP-UHFFFAOYSA-N Synonym: 4-chlorobenzyl chloride,1-chloro-4-chloromethyl benzene,p-chlorobenzyl chloride,benzene, 1-chloro-4-chloromethyl,alpha,4-dichlorotoluene,4-chlorobenzylchloride,4-chlorophenyl methyl chloride,1-chloro-4-chloromethyl-benzene,alpha,p-dichlorotoluene,toluene, p,alpha-dichloro PubChem CID: 7723 IUPAC Name: 1-chloro-4-(chloromethyl)benzene SMILES: C1=CC(=CC=C1CCl)Cl

PubChem CID 7723
CAS 104-83-6
Molecular Weight (g/mol) 161.025
MDL Number MFCD00000914
SMILES C1=CC(=CC=C1CCl)Cl
Synonym 4-chlorobenzyl chloride,1-chloro-4-chloromethyl benzene,p-chlorobenzyl chloride,benzene, 1-chloro-4-chloromethyl,alpha,4-dichlorotoluene,4-chlorobenzylchloride,4-chlorophenyl methyl chloride,1-chloro-4-chloromethyl-benzene,alpha,p-dichlorotoluene,toluene, p,alpha-dichloro
IUPAC Name 1-chloro-4-(chloromethyl)benzene
InChI Key JQZAEUFPPSRDOP-UHFFFAOYSA-N
Molecular Formula C7H6Cl2
6,324

3-Fluorobenzyl Alcohol 97.0+%, TCI America™

CAS: 456-47-3 Molecular Formula: C7H7FO Molecular Weight (g/mol): 126.13 MDL Number: MFCD00004631 InChI Key: QDHRSLFSDGCJFX-UHFFFAOYSA-N Synonym: 3-fluorobenzyl alcohol,3-fluorophenyl methanol,m-fluorobenzyl alcohol,benzenemethanol, 3-fluoro,3-fluorobenzylalcohol,3-fluorobenzylic alcohol,benzyl alcohol, m-fluoro,3-fluorophenyl methan-1-ol,3-florobenzyl alcohol,pubchem3486 PubChem CID: 68008 IUPAC Name: (3-fluorophenyl)methanol SMILES: C1=CC(=CC(=C1)F)CO

PubChem CID 68008
CAS 456-47-3
Molecular Weight (g/mol) 126.13
MDL Number MFCD00004631
SMILES C1=CC(=CC(=C1)F)CO
Synonym 3-fluorobenzyl alcohol,3-fluorophenyl methanol,m-fluorobenzyl alcohol,benzenemethanol, 3-fluoro,3-fluorobenzylalcohol,3-fluorobenzylic alcohol,benzyl alcohol, m-fluoro,3-fluorophenyl methan-1-ol,3-florobenzyl alcohol,pubchem3486
IUPAC Name (3-fluorophenyl)methanol
InChI Key QDHRSLFSDGCJFX-UHFFFAOYSA-N
Molecular Formula C7H7FO
6,325

2-(Hydroxymethyl)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™

PubChem CID 4374262
CAS 87199-14-2
MDL Number MFCD02258966
Color White-Yellow
Physical Form Crystalline Powder
TSCA No
IUPAC Name [2-(hydroxymethyl)phenyl]boronic acid
InChI Key AFHOBSCDNXGFMO-UHFFFAOYSA-N
Molecular Formula C7H9BO3
Formula Weight 151.96
6,326

N-(tert-Butoxycarbonyl)-O-benzyl-L-serine 98.0+%, TCI America™

CAS: 23680-31-1 Molecular Formula: C15H21NO5 Molecular Weight (g/mol): 295.335 MDL Number: MFCD00066063 InChI Key: DMBKPDOAQVGTST-LBPRGKRZSA-N Synonym: boc-ser bzl-oh,n-boc-o-benzyl-l-serine,boc-o-benzyl-l-serine,boc-ser bzl,s-3-benzyloxy-2-tert-butoxycarbonyl amino propanoic acid,n-1,1-dimethylethoxy carbonyl-o-phenylmethyl-l-serine,n-t-butoxycarbonyl-o-benzyl-l-serine,o-benzyl-n-tert-butyloxycarbonylserine,n-tert-butoxycarbonyl-o-benzyl-l-serine,o-benzyl-n-tert-butoxycarbonyl-l-serine PubChem CID: 90234 IUPAC Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxypropanoic acid SMILES: CC(C)(C)OC(=O)NC(COCC1=CC=CC=C1)C(=O)O

PubChem CID 90234
CAS 23680-31-1
Molecular Weight (g/mol) 295.335
MDL Number MFCD00066063
SMILES CC(C)(C)OC(=O)NC(COCC1=CC=CC=C1)C(=O)O
Synonym boc-ser bzl-oh,n-boc-o-benzyl-l-serine,boc-o-benzyl-l-serine,boc-ser bzl,s-3-benzyloxy-2-tert-butoxycarbonyl amino propanoic acid,n-1,1-dimethylethoxy carbonyl-o-phenylmethyl-l-serine,n-t-butoxycarbonyl-o-benzyl-l-serine,o-benzyl-n-tert-butyloxycarbonylserine,n-tert-butoxycarbonyl-o-benzyl-l-serine,o-benzyl-n-tert-butoxycarbonyl-l-serine
IUPAC Name (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxypropanoic acid
InChI Key DMBKPDOAQVGTST-LBPRGKRZSA-N
Molecular Formula C15H21NO5
6,327

Methyl 4-(Chloromethyl)benzoate 98.0+%, TCI America™

CAS: 34040-64-7 Molecular Formula: C9H9ClO2 Molecular Weight (g/mol): 184.619 MDL Number: MFCD00511224 InChI Key: SATDLKYRVXFXRE-UHFFFAOYSA-N Synonym: methyl 4-chloromethyl benzoate,4-chloromethyl benzoic acid methyl ester,methyl-4-chloromethylbenzoate,benzoic acid, 4-chloromethyl-, methyl ester,4-methoxycarbonyl benzyl chloride,methyl alpha-chloro-p-toluate,methyl p-chloromethyl benzoate,p-methoxycarbonyl benzyl chloride,methyl a-chloro-p-toluate,p-toluic acid, .alpha.-chloro-, methyl ester PubChem CID: 36664 IUPAC Name: methyl 4-(chloromethyl)benzoate SMILES: COC(=O)C1=CC=C(C=C1)CCl

PubChem CID 36664
CAS 34040-64-7
Molecular Weight (g/mol) 184.619
MDL Number MFCD00511224
SMILES COC(=O)C1=CC=C(C=C1)CCl
Synonym methyl 4-chloromethyl benzoate,4-chloromethyl benzoic acid methyl ester,methyl-4-chloromethylbenzoate,benzoic acid, 4-chloromethyl-, methyl ester,4-methoxycarbonyl benzyl chloride,methyl alpha-chloro-p-toluate,methyl p-chloromethyl benzoate,p-methoxycarbonyl benzyl chloride,methyl a-chloro-p-toluate,p-toluic acid, .alpha.-chloro-, methyl ester
IUPAC Name methyl 4-(chloromethyl)benzoate
InChI Key SATDLKYRVXFXRE-UHFFFAOYSA-N
Molecular Formula C9H9ClO2
6,328

alpha,alpha'-Bis(4-methylbenzyloxy)-p-xylene 98.0+%, TCI America™

CAS: 136861-46-6 Molecular Formula: C24H26O2 Molecular Weight (g/mol): 346.47 MDL Number: MFCD00143577 InChI Key: IJMQICMKIDWWAK-UHFFFAOYSA-N Synonym: p-Xylylene Glycol Bis(4-methylbenzyl) Ether PubChem CID: 21659525 IUPAC Name: 1,4-bis[(4-methylphenyl)methoxymethyl]benzene SMILES: CC1=CC=C(C=C1)COCC2=CC=C(C=C2)COCC3=CC=C(C=C3)C

PubChem CID 21659525
CAS 136861-46-6
Molecular Weight (g/mol) 346.47
MDL Number MFCD00143577
SMILES CC1=CC=C(C=C1)COCC2=CC=C(C=C2)COCC3=CC=C(C=C3)C
Synonym p-Xylylene Glycol Bis(4-methylbenzyl) Ether
IUPAC Name 1,4-bis[(4-methylphenyl)methoxymethyl]benzene
InChI Key IJMQICMKIDWWAK-UHFFFAOYSA-N
Molecular Formula C24H26O2
6,329

3,5-Dibenzyloxybenzyl Bromide 98.0+%, TCI America™

CAS: 24131-32-6 Molecular Formula: C21H19BrO2 Molecular Weight (g/mol): 383.285 MDL Number: MFCD02093444 InChI Key: WGMYJGAUAQXYFQ-UHFFFAOYSA-N Synonym: 3,5-Bis(benzyloxy)benzyl Bromide, 3,5-Dibenzyloxy-alpha-bromotoluene PubChem CID: 2761019 IUPAC Name: 1-(bromomethyl)-3,5-bis(phenylmethoxy)benzene SMILES: C1=CC=C(C=C1)COC2=CC(=CC(=C2)CBr)OCC3=CC=CC=C3

PubChem CID 2761019
CAS 24131-32-6
Molecular Weight (g/mol) 383.285
MDL Number MFCD02093444
SMILES C1=CC=C(C=C1)COC2=CC(=CC(=C2)CBr)OCC3=CC=CC=C3
Synonym 3,5-Bis(benzyloxy)benzyl Bromide, 3,5-Dibenzyloxy-alpha-bromotoluene
IUPAC Name 1-(bromomethyl)-3,5-bis(phenylmethoxy)benzene
InChI Key WGMYJGAUAQXYFQ-UHFFFAOYSA-N
Molecular Formula C21H19BrO2
6,330

4-(Methylthio)benzyl Alcohol 98.0+%, TCI America™

CAS: 3446-90-0 Molecular Formula: C8H10OS Molecular Weight (g/mol): 154.227 MDL Number: MFCD00009706 InChI Key: MTXQKSQYMREAGJ-UHFFFAOYSA-N Synonym: 4-methylthio benzyl alcohol,4-methylthio phenyl methanol,p-methylthiobenzyl alcohol,4-methylsulfanyl phenyl methanol,4-methylthiobenzyl alcohol,4-methylthio benzylalcohol,p-methylthio benzyl alcohol,4-methylsulfanylphenyl methanol,4-hydroxymethyl thioanisole PubChem CID: 592968 IUPAC Name: (4-methylsulfanylphenyl)methanol SMILES: CSC1=CC=C(C=C1)CO

PubChem CID 592968
CAS 3446-90-0
Molecular Weight (g/mol) 154.227
MDL Number MFCD00009706
SMILES CSC1=CC=C(C=C1)CO
Synonym 4-methylthio benzyl alcohol,4-methylthio phenyl methanol,p-methylthiobenzyl alcohol,4-methylsulfanyl phenyl methanol,4-methylthiobenzyl alcohol,4-methylthio benzylalcohol,p-methylthio benzyl alcohol,4-methylsulfanylphenyl methanol,4-hydroxymethyl thioanisole
IUPAC Name (4-methylsulfanylphenyl)methanol
InChI Key MTXQKSQYMREAGJ-UHFFFAOYSA-N
Molecular Formula C8H10OS