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.

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7,636 – 7,650 of 78,418 results

7,636

4-Bromobenzyl Alcohol 99.0+%, TCI America™

CAS: 873-75-6 Molecular Formula: C7H7BrO Molecular Weight (g/mol): 187.036 MDL Number: MFCD00004650 InChI Key: VEDDBHYQWFOITD-UHFFFAOYSA-N Synonym: 4-bromobenzyl alcohol,4-bromophenyl methanol,p-bromobenzyl alcohol,benzenemethanol, 4-bromo,para-bromobenzyl alcohol,4-bromobenzylalcohol,p-bromo-benzyl alcohol,ccris 5119,4-bromophenyl-methanol,benzyl alcohol, p-bromo PubChem CID: 70119 IUPAC Name: (4-bromophenyl)methanol SMILES: C1=CC(=CC=C1CO)Br

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Specifications

PubChem CID	70119
CAS	873-75-6
Molecular Weight (g/mol)	187.036
MDL Number	MFCD00004650
SMILES	C1=CC(=CC=C1CO)Br
Synonym	4-bromobenzyl alcohol,4-bromophenyl methanol,p-bromobenzyl alcohol,benzenemethanol, 4-bromo,para-bromobenzyl alcohol,4-bromobenzylalcohol,p-bromo-benzyl alcohol,ccris 5119,4-bromophenyl-methanol,benzyl alcohol, p-bromo
IUPAC Name	(4-bromophenyl)methanol
InChI Key	VEDDBHYQWFOITD-UHFFFAOYSA-N
Molecular Formula	C7H7BrO

7,637

3-Bromobenzyl Alcohol 98.0+%, TCI America™

CAS: 15852-73-0 Molecular Formula: C7H7BrO Molecular Weight (g/mol): 187.036 MDL Number: MFCD00004629 InChI Key: FSWNRRSWFBXQCL-UHFFFAOYSA-N Synonym: 3-bromobenzyl alcohol,3-bromophenyl methanol,m-bromobenzyl alcohol,benzenemethanol, 3-bromo,3-bromobenzylalcohol,3-bromophenyl methan-1-ol,3-bromo-benzenemethanol,m-bromobenzylalcohol,3-bromo benzylalcohol,pubchem3747 PubChem CID: 85141 IUPAC Name: (3-bromophenyl)methanol SMILES: C1=CC(=CC(=C1)Br)CO

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Specifications

PubChem CID	85141
CAS	15852-73-0
Molecular Weight (g/mol)	187.036
MDL Number	MFCD00004629
SMILES	C1=CC(=CC(=C1)Br)CO
Synonym	3-bromobenzyl alcohol,3-bromophenyl methanol,m-bromobenzyl alcohol,benzenemethanol, 3-bromo,3-bromobenzylalcohol,3-bromophenyl methan-1-ol,3-bromo-benzenemethanol,m-bromobenzylalcohol,3-bromo benzylalcohol,pubchem3747
IUPAC Name	(3-bromophenyl)methanol
InChI Key	FSWNRRSWFBXQCL-UHFFFAOYSA-N
Molecular Formula	C7H7BrO

7,638

4-Chloro-2-fluorobenzyl Bromide 98.0+%, TCI America™

CAS: 71916-82-0 Molecular Formula: C7H5BrClF Molecular Weight (g/mol): 223.469 MDL Number: MFCD00831105 InChI Key: UFCSSWZQROEFBZ-UHFFFAOYSA-N Synonym: 1-bromomethyl-4-chloro-2-fluorobenzene,4-chloro-2-fluorobenzyl bromide,2-fluoro-4-chlorobenzyl bromide,4-chloro-2-fluorobenzylbromide,alpha-bromo-4-chloro-2-fluorotoluene,benzene, 1-bromomethyl-4-chloro-2-fluoro,pubchem4897,1-bromomethyl-4-chloro-2-fluoro-benzene,acmc-209okn PubChem CID: 2736551 IUPAC Name: 1-(bromomethyl)-4-chloro-2-fluorobenzene SMILES: C1=CC(=C(C=C1Cl)F)CBr

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Specifications

PubChem CID	2736551
CAS	71916-82-0
Molecular Weight (g/mol)	223.469
MDL Number	MFCD00831105
SMILES	C1=CC(=C(C=C1Cl)F)CBr
Synonym	1-bromomethyl-4-chloro-2-fluorobenzene,4-chloro-2-fluorobenzyl bromide,2-fluoro-4-chlorobenzyl bromide,4-chloro-2-fluorobenzylbromide,alpha-bromo-4-chloro-2-fluorotoluene,benzene, 1-bromomethyl-4-chloro-2-fluoro,pubchem4897,1-bromomethyl-4-chloro-2-fluoro-benzene,acmc-209okn
IUPAC Name	1-(bromomethyl)-4-chloro-2-fluorobenzene
InChI Key	UFCSSWZQROEFBZ-UHFFFAOYSA-N
Molecular Formula	C7H5BrClF

7,639

N-trans-Cinnamyl-N-methyl-(1-naphthylmethyl)amine Hydrochloride 98.0+%, TCI America™

CAS: 65473-14-5 Molecular Formula: C21H22ClN Molecular Weight (g/mol): 323.864 MDL Number: MFCD00059047 InChI Key: OLUNPKFOFGZHRT-YGCVIUNWSA-N Synonym: naftifine hydrochloride,naftifine hcl,naftin,exoderil,naftifungin,n-trans-cinnamyl-n-methyl-1-naphthylmethyl amine hydrochloride,e-n-cinnamyl-n-methyl-1-naphthalenemethylamine hydrochloride,naftin tn,e-n-methyl-n-1-naphthylmethyl-3-phenyl-2-propen-1-amine-hydrochloride PubChem CID: 5281098 ChEBI: CHEBI:7452 IUPAC Name: (E)-N-methyl-N-(naphthalen-1-ylmethyl)-3-phenylprop-2-en-1-amine;hydrochloride SMILES: CN(CC=CC1=CC=CC=C1)CC2=CC=CC3=CC=CC=C32.Cl

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Specifications

PubChem CID	5281098
CAS	65473-14-5
Molecular Weight (g/mol)	323.864
ChEBI	CHEBI:7452
MDL Number	MFCD00059047
SMILES	CN(CC=CC1=CC=CC=C1)CC2=CC=CC3=CC=CC=C32.Cl
Synonym	naftifine hydrochloride,naftifine hcl,naftin,exoderil,naftifungin,n-trans-cinnamyl-n-methyl-1-naphthylmethyl amine hydrochloride,e-n-cinnamyl-n-methyl-1-naphthalenemethylamine hydrochloride,naftin tn,e-n-methyl-n-1-naphthylmethyl-3-phenyl-2-propen-1-amine-hydrochloride
IUPAC Name	(E)-N-methyl-N-(naphthalen-1-ylmethyl)-3-phenylprop-2-en-1-amine;hydrochloride
InChI Key	OLUNPKFOFGZHRT-YGCVIUNWSA-N
Molecular Formula	C21H22ClN

7,640

3-Vinylphenylboronic Acid (contains varying amounts of Anhydride), TCI America™

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Specifications

Molecular Weight (g/mol)	147.968
Color	White
Physical Form	Crystalline Powder
Chemical Name or Material	3-Vinylphenylboronic Acid (contains varying amounts of Anhydride)
SMILES	B(C1=CC(=CC=C1)C=C)(O)O
InChI Key	SYBQEKBVWDPVJM-UHFFFAOYSA-N
PubChem CID	4366886
CAS	15016-43-0
MDL Number	MFCD01074679
TSCA	No
IUPAC Name	(3-ethenylphenyl)boronic acid
Molecular Formula	C8H9BO2
Formula Weight	147.97
Melting Point	145°C

7,641

1-Octadecyl-4-(4-phenyl-1,3-butadienyl)pyridinium Bromide 96.0+%, TCI America™

CAS: 165678-32-0 Molecular Formula: C33H50BrN Molecular Weight (g/mol): 540.674 MDL Number: MFCD00060045 InChI Key: GERCFVKULBVBIO-UHFFFAOYSA-M PubChem CID: 53411749 IUPAC Name: 1-octadecyl-4-(4-phenylbuta-1,3-dienyl)pyridin-1-ium;bromide SMILES: CCCCCCCCCCCCCCCCCC[N+]1=CC=C(C=C1)C=CC=CC2=CC=CC=C2.[Br-]

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Specifications

PubChem CID	53411749
CAS	165678-32-0
Molecular Weight (g/mol)	540.674
MDL Number	MFCD00060045
SMILES	CCCCCCCCCCCCCCCCCC[N+]1=CC=C(C=C1)C=CC=CC2=CC=CC=C2.[Br-]
IUPAC Name	1-octadecyl-4-(4-phenylbuta-1,3-dienyl)pyridin-1-ium;bromide
InChI Key	GERCFVKULBVBIO-UHFFFAOYSA-M
Molecular Formula	C33H50BrN

7,642

Pentafluorobenzyl Alcohol 96.0+%, TCI America™

CAS: 440-60-8 Molecular Formula: C7H3F5O Molecular Weight (g/mol): 198.092 MDL Number: MFCD00004602 InChI Key: PGJYYCIOYBZTPU-UHFFFAOYSA-N Synonym: 2,3,4,5,6-pentafluorobenzyl alcohol,pentafluorobenzyl alcohol,perfluorophenyl methanol,pentafluorophenyl methanol,2,3,4,5,6-pentafluorophenyl methanol,2,3,4,5,6-pentafluorobenzenemethanol,hydroxymethyl pentafluorobenzene,benzenemethanol, 2,3,4,5,6-pentafluoro,pentafluorobenzylalcohol,2,3,4,5,6-pentafluorobenzylalcohol PubChem CID: 9923 ChEBI: CHEBI:44903 IUPAC Name: (2,3,4,5,6-pentafluorophenyl)methanol SMILES: C(C1=C(C(=C(C(=C1F)F)F)F)F)O

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Specifications

PubChem CID	9923
CAS	440-60-8
Molecular Weight (g/mol)	198.092
ChEBI	CHEBI:44903
MDL Number	MFCD00004602
SMILES	C(C1=C(C(=C(C(=C1F)F)F)F)F)O
Synonym	2,3,4,5,6-pentafluorobenzyl alcohol,pentafluorobenzyl alcohol,perfluorophenyl methanol,pentafluorophenyl methanol,2,3,4,5,6-pentafluorophenyl methanol,2,3,4,5,6-pentafluorobenzenemethanol,hydroxymethyl pentafluorobenzene,benzenemethanol, 2,3,4,5,6-pentafluoro,pentafluorobenzylalcohol,2,3,4,5,6-pentafluorobenzylalcohol
IUPAC Name	(2,3,4,5,6-pentafluorophenyl)methanol
InChI Key	PGJYYCIOYBZTPU-UHFFFAOYSA-N
Molecular Formula	C7H3F5O

7,643

Trimethoxy(4-vinylphenyl)silane 97.0+%, TCI America™

CAS: 18001-13-3 Molecular Formula: C11H16O3Si Molecular Weight (g/mol): 224.33 MDL Number: MFCD21596662 InChI Key: LTQBNYCMVZQRSD-UHFFFAOYSA-N PubChem CID: 15606295 IUPAC Name: (4-ethenylphenyl)trimethoxysilane SMILES: CO[Si](OC)(OC)C1=CC=C(C=C)C=C1

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Specifications

PubChem CID	15606295
CAS	18001-13-3
Molecular Weight (g/mol)	224.33
MDL Number	MFCD21596662
SMILES	CO[Si](OC)(OC)C1=CC=C(C=C)C=C1
IUPAC Name	(4-ethenylphenyl)trimethoxysilane
InChI Key	LTQBNYCMVZQRSD-UHFFFAOYSA-N
Molecular Formula	C11H16O3Si

7,644

Dienestrol 96.0+%, TCI America™

CAS: 84-17-3 Molecular Formula: C18H18O2 Molecular Weight (g/mol): 266.34 MDL Number: MFCD00050983 InChI Key: NFDFQCUYFHCNBW-SCGPFSFSSA-N PubChem CID: 667476 IUPAC Name: 4-[(2E,4E)-4-(4-hydroxyphenyl)hexa-2,4-dien-3-yl]phenol SMILES: CC=C(C1=CC=C(C=C1)O)C(=CC)C2=CC=C(C=C2)O

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Specifications

PubChem CID	667476
CAS	84-17-3
Molecular Weight (g/mol)	266.34
MDL Number	MFCD00050983
SMILES	CC=C(C1=CC=C(C=C1)O)C(=CC)C2=CC=C(C=C2)O
IUPAC Name	4-[(2E,4E)-4-(4-hydroxyphenyl)hexa-2,4-dien-3-yl]phenol
InChI Key	NFDFQCUYFHCNBW-SCGPFSFSSA-N
Molecular Formula	C18H18O2

7,645

2,2'-Dihydroxybiphenyl 98.0+%, TCI America™

CAS: 1806-29-7 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00002210 InChI Key: IMHDGJOMLMDPJN-UHFFFAOYSA-N Synonym: 2,2'-biphenol,1,1'-biphenyl-2,2'-diol,2,2'-dihydroxybiphenyl,biphenyl-2,2'-diol,o,o'-diphenol,o,o'-biphenol,o-dihydroxydiphenyl,o,o'-dihydroxybiphenyl,2,2'-biphenyldiol,2,2'-dihydroxydiphenyl PubChem CID: 15731 ChEBI: CHEBI:28970 IUPAC Name: [1,1'-biphenyl]-2,2'-diol SMILES: OC1=CC=CC=C1C1=CC=CC=C1O

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Specifications

PubChem CID	15731
CAS	1806-29-7
Molecular Weight (g/mol)	186.21
ChEBI	CHEBI:28970
MDL Number	MFCD00002210
SMILES	OC1=CC=CC=C1C1=CC=CC=C1O
Synonym	2,2'-biphenol,1,1'-biphenyl-2,2'-diol,2,2'-dihydroxybiphenyl,biphenyl-2,2'-diol,o,o'-diphenol,o,o'-biphenol,o-dihydroxydiphenyl,o,o'-dihydroxybiphenyl,2,2'-biphenyldiol,2,2'-dihydroxydiphenyl
IUPAC Name	[1,1'-biphenyl]-2,2'-diol
InChI Key	IMHDGJOMLMDPJN-UHFFFAOYSA-N
Molecular Formula	C12H10O2

7,646

2,6-Dimethoxyphenol 98.0+%, TCI America™

CAS: 91-10-1 Molecular Formula: C8H10O3 Molecular Weight (g/mol): 154.17 MDL Number: MFCD00064434 InChI Key: KLIDCXVFHGNTTM-UHFFFAOYSA-N Synonym: syringol,pyrogallol 1,3-dimethyl ether,1,3-dimethyl pyrogallate,phenol, 2,6-dimethoxy,2-hydroxy-1,3-dimethoxybenzene,1,3-di-o-methylpyrogallol,1,3-dimethoxy-2-hydroxybenzene,2,6-dimethoxy-phenol,pyrogallol dimethylether,2,6-dwumetoksyfenol PubChem CID: 7041 ChEBI: CHEBI:955 IUPAC Name: 2,6-dimethoxyphenol SMILES: COC1=CC=CC(OC)=C1O

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Specifications

PubChem CID	7041
CAS	91-10-1
Molecular Weight (g/mol)	154.17
ChEBI	CHEBI:955
MDL Number	MFCD00064434
SMILES	COC1=CC=CC(OC)=C1O
Synonym	syringol,pyrogallol 1,3-dimethyl ether,1,3-dimethyl pyrogallate,phenol, 2,6-dimethoxy,2-hydroxy-1,3-dimethoxybenzene,1,3-di-o-methylpyrogallol,1,3-dimethoxy-2-hydroxybenzene,2,6-dimethoxy-phenol,pyrogallol dimethylether,2,6-dwumetoksyfenol
IUPAC Name	2,6-dimethoxyphenol
InChI Key	KLIDCXVFHGNTTM-UHFFFAOYSA-N
Molecular Formula	C8H10O3

7,647

Dobutamine Hydrochloride 98.0+%, TCI America™

CAS: 49745-95-1 Molecular Formula: C18H24ClNO3 Molecular Weight (g/mol): 337.84 MDL Number: MFCD00153795 InChI Key: BQKADKWNRWCIJL-UHFFFAOYNA-N Synonym: dobutamine hydrochloride,dobutamine hcl,dobutrex,inotrex,dl-dobutamine hydrochloride,dobutamina clorhidrato spanish,4-2-4-4-hydroxyphenyl butan-2-ylamino ethyl benzene-1,2-diol hydrochloride,+--4-2-3-p-hydroxyphenyl-1-methylpropyl amino ethyl pyrocatechol hydrochloride,1,2-benzenediol, 4-2-3-4-hydroxyphenyl-1-methylpropyl amino ethyl-, hydrochloride, +- PubChem CID: 65324 ChEBI: CHEBI:4671 IUPAC Name: hydrogen 4-(2-{[4-(4-hydroxyphenyl)butan-2-yl]amino}ethyl)benzene-1,2-diol chloride SMILES: [H+].[Cl-].CC(CCC1=CC=C(O)C=C1)NCCC1=CC=C(O)C(O)=C1

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Specifications

PubChem CID	65324
CAS	49745-95-1
Molecular Weight (g/mol)	337.84
ChEBI	CHEBI:4671
MDL Number	MFCD00153795
SMILES	[H+].[Cl-].CC(CCC1=CC=C(O)C=C1)NCCC1=CC=C(O)C(O)=C1
Synonym	dobutamine hydrochloride,dobutamine hcl,dobutrex,inotrex,dl-dobutamine hydrochloride,dobutamina clorhidrato spanish,4-2-4-4-hydroxyphenyl butan-2-ylamino ethyl benzene-1,2-diol hydrochloride,+--4-2-3-p-hydroxyphenyl-1-methylpropyl amino ethyl pyrocatechol hydrochloride,1,2-benzenediol, 4-2-3-4-hydroxyphenyl-1-methylpropyl amino ethyl-, hydrochloride, +-
IUPAC Name	hydrogen 4-(2-{[4-(4-hydroxyphenyl)butan-2-yl]amino}ethyl)benzene-1,2-diol chloride
InChI Key	BQKADKWNRWCIJL-UHFFFAOYNA-N
Molecular Formula	C18H24ClNO3

7,648

3-Ethoxyphenol 97.0+%, TCI America™

CAS: 621-34-1 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00016450 InChI Key: VBIKLMJHBGFTPV-UHFFFAOYSA-N Synonym: m-ethoxyphenol,phenol, 3-ethoxy,phenol, m-ethoxy,resorcinol monoethyl ether,3-ethoxy-phenol,unii-iky4o3474a,3-ethyloxy phenol,pubchem9510,acmc-209mzu,phenol, m-ethoxy-8ci PubChem CID: 69306 IUPAC Name: 3-ethoxyphenol SMILES: CCOC1=CC=CC(=C1)O

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Specifications

PubChem CID	69306
CAS	621-34-1
Molecular Weight (g/mol)	138.166
MDL Number	MFCD00016450
SMILES	CCOC1=CC=CC(=C1)O
Synonym	m-ethoxyphenol,phenol, 3-ethoxy,phenol, m-ethoxy,resorcinol monoethyl ether,3-ethoxy-phenol,unii-iky4o3474a,3-ethyloxy phenol,pubchem9510,acmc-209mzu,phenol, m-ethoxy-8ci
IUPAC Name	3-ethoxyphenol
InChI Key	VBIKLMJHBGFTPV-UHFFFAOYSA-N
Molecular Formula	C8H10O2

7,649

(R)-(-)-N-(3,5-Dinitrobenzoyl)-alpha-phenylglycine 98.0+%, TCI America™

CAS: 74927-72-3 Molecular Formula: C15H10N3O7 Molecular Weight (g/mol): 344.26 MDL Number: MFCD00010134,MFCD00010134,MFCD00064470 InChI Key: MIVUDAUOXJDARR-CYBMUJFWSA-M PubChem CID: 126504 IUPAC Name: (2R)-2-[(3,5-dinitrophenyl)formamido]-2-phenylacetate SMILES: [O-]C(=O)[C@H](NC(=O)C1=CC(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O)C1=CC=CC=C1

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Specifications

PubChem CID	126504
CAS	74927-72-3
Molecular Weight (g/mol)	344.26
MDL Number	MFCD00010134,MFCD00010134,MFCD00064470
SMILES	[O-]C(=O)[C@H](NC(=O)C1=CC(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O)C1=CC=CC=C1
IUPAC Name	(2R)-2-[(3,5-dinitrophenyl)formamido]-2-phenylacetate
InChI Key	MIVUDAUOXJDARR-CYBMUJFWSA-M
Molecular Formula	C15H10N3O7

7,650

3,4-Dimethylhippuric Acid 98.0+%, TCI America™

CAS: 23082-12-4 Molecular Formula: C11H12NO3 Molecular Weight (g/mol): 206.22 MDL Number: MFCD00191414 InChI Key: ZDHXVMSVUHHHAE-UHFFFAOYSA-M Synonym: N-(3,4-Dimethylbenzoyl)glycine PubChem CID: 152464 IUPAC Name: 2-[(3,4-dimethylphenyl)formamido]acetate SMILES: CC1=CC=C(C=C1C)C(=O)NCC([O-])=O

Pricing & Availability
Specifications

PubChem CID	152464
CAS	23082-12-4
Molecular Weight (g/mol)	206.22
MDL Number	MFCD00191414
SMILES	CC1=CC=C(C=C1C)C(=O)NCC([O-])=O
Synonym	N-(3,4-Dimethylbenzoyl)glycine
IUPAC Name	2-[(3,4-dimethylphenyl)formamido]acetate
InChI Key	ZDHXVMSVUHHHAE-UHFFFAOYSA-M
Molecular Formula	C11H12NO3

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