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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6,781 – 6,795 of 159,118 results

6,781

2-Iodo-9,9-dimethylfluorene 98.0+%, TCI America™

CAS: 144981-85-1 Molecular Formula: C15H13I Molecular Weight (g/mol): 320.17 MDL Number: MFCD12024272 InChI Key: DVLSJPCXPNKPRJ-UHFFFAOYSA-N PubChem CID: 11023630 IUPAC Name: 2-iodo-9,9-dimethyl-9H-fluorene SMILES: CC1(C)C2=CC=CC=C2C2=C1C=C(I)C=C2

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Specifications

PubChem CID	11023630
CAS	144981-85-1
Molecular Weight (g/mol)	320.17
MDL Number	MFCD12024272
SMILES	CC1(C)C2=CC=CC=C2C2=C1C=C(I)C=C2
IUPAC Name	2-iodo-9,9-dimethyl-9H-fluorene
InChI Key	DVLSJPCXPNKPRJ-UHFFFAOYSA-N
Molecular Formula	C15H13I

6,782

N,N-Diethyl-m-toluidine 99.0+%, TCI America™

CAS: 91-67-8 Molecular Formula: C11H17N Molecular Weight (g/mol): 163.26 MDL Number: MFCD00035795 InChI Key: CIPVVROJHKLHJI-UHFFFAOYSA-N Synonym: n,n-diethyl-m-toluidine,benzenamine, n,n-diethyl-3-methyl,3-diethylamino toluene,3-n,n-diethylamino toluene,m-methyl-n,n-diethylaniline,1-diethylamino-3-methylbenzene,3-diethylamino-1-methylbenzene,n,n-diethyl-m-toluidinium ion,m-toluidine, n,n-diethyl,meta-methyl diethylamino benzene PubChem CID: 66679 IUPAC Name: N,N-diethyl-3-methylaniline SMILES: CCN(CC)C1=CC=CC(C)=C1

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Specifications

PubChem CID	66679
CAS	91-67-8
Molecular Weight (g/mol)	163.26
MDL Number	MFCD00035795
SMILES	CCN(CC)C1=CC=CC(C)=C1
Synonym	n,n-diethyl-m-toluidine,benzenamine, n,n-diethyl-3-methyl,3-diethylamino toluene,3-n,n-diethylamino toluene,m-methyl-n,n-diethylaniline,1-diethylamino-3-methylbenzene,3-diethylamino-1-methylbenzene,n,n-diethyl-m-toluidinium ion,m-toluidine, n,n-diethyl,meta-methyl diethylamino benzene
IUPAC Name	N,N-diethyl-3-methylaniline
InChI Key	CIPVVROJHKLHJI-UHFFFAOYSA-N
Molecular Formula	C11H17N

6,783

2,7-Diamino-9,9-di-n-octylfluorene 98.0+%, TCI America™

CAS: 851042-10-9 Molecular Formula: C29H44N2 Molecular Weight (g/mol): 420.69 MDL Number: MFCD27923070 InChI Key: ODJBGRHFVFWTBO-UHFFFAOYSA-N PubChem CID: 59306005 IUPAC Name: 9,9-dioctyl-9H-fluorene-2,7-diamine SMILES: CCCCCCCCC1(CCCCCCCC)C2=C(C=CC(N)=C2)C2=C1C=C(N)C=C2

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Specifications

PubChem CID	59306005
CAS	851042-10-9
Molecular Weight (g/mol)	420.69
MDL Number	MFCD27923070
SMILES	CCCCCCCCC1(CCCCCCCC)C2=C(C=CC(N)=C2)C2=C1C=C(N)C=C2
IUPAC Name	9,9-dioctyl-9H-fluorene-2,7-diamine
InChI Key	ODJBGRHFVFWTBO-UHFFFAOYSA-N
Molecular Formula	C29H44N2

6,784

4-Bromo-3-methylaniline 98.0+%, TCI America™

CAS: 6933-10-4 Molecular Formula: C7H8BrN Molecular Weight (g/mol): 186.05 MDL Number: MFCD00007828 InChI Key: MMEGELSFOYDPQW-UHFFFAOYSA-N Synonym: 4-bromo-m-toluidine,5-amino-2-bromotoluene,3-methyl-4-bromoaniline,benzenamine, 4-bromo-3-methyl,4-bromo-3-methyl-phenylamine,4-bromo-3-methyl-aniline,4-bromo-3-methylbenzenamine,4-bromo-3-methylphenylamine,pubchem4339,4-bromo3-methylaniline PubChem CID: 23359 IUPAC Name: 4-bromo-3-methylaniline SMILES: CC1=C(C=CC(=C1)N)Br

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Specifications

PubChem CID	23359
CAS	6933-10-4
Molecular Weight (g/mol)	186.05
MDL Number	MFCD00007828
SMILES	CC1=C(C=CC(=C1)N)Br
Synonym	4-bromo-m-toluidine,5-amino-2-bromotoluene,3-methyl-4-bromoaniline,benzenamine, 4-bromo-3-methyl,4-bromo-3-methyl-phenylamine,4-bromo-3-methyl-aniline,4-bromo-3-methylbenzenamine,4-bromo-3-methylphenylamine,pubchem4339,4-bromo3-methylaniline
IUPAC Name	4-bromo-3-methylaniline
InChI Key	MMEGELSFOYDPQW-UHFFFAOYSA-N
Molecular Formula	C7H8BrN

6,785

3-Iodo-4-methylaniline 98.0+%, TCI America™

CAS: 35944-64-0 Molecular Formula: C7H8IN Molecular Weight (g/mol): 233.05 MDL Number: MFCD00047843 InChI Key: RRUDMHNAMZFNEK-UHFFFAOYSA-N Synonym: 3-iodo-p-toluidine,benzenamine, 3-iodo-4-methyl,4-amino-2-iodotoluene,p-toluidine, 3-iodo,3-iodo-4-methyl-aniline,benzenamine, 3-iodo-4-methyl-9ci,3-iodo-4-methyl-phenylamine,pubchem3314,3-iodo-4-methyl aniline,acmc-209ik4 PubChem CID: 118889 IUPAC Name: 3-iodo-4-methylaniline SMILES: CC1=CC=C(N)C=C1I

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Specifications

PubChem CID	118889
CAS	35944-64-0
Molecular Weight (g/mol)	233.05
MDL Number	MFCD00047843
SMILES	CC1=CC=C(N)C=C1I
Synonym	3-iodo-p-toluidine,benzenamine, 3-iodo-4-methyl,4-amino-2-iodotoluene,p-toluidine, 3-iodo,3-iodo-4-methyl-aniline,benzenamine, 3-iodo-4-methyl-9ci,3-iodo-4-methyl-phenylamine,pubchem3314,3-iodo-4-methyl aniline,acmc-209ik4
IUPAC Name	3-iodo-4-methylaniline
InChI Key	RRUDMHNAMZFNEK-UHFFFAOYSA-N
Molecular Formula	C7H8IN

6,786

4-Bromo-2,6-dimethylphenol 98.0+%, TCI America™

CAS: 2374-05-2 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.06 MDL Number: MFCD00002314 InChI Key: ZLVFYUORUHNMBO-UHFFFAOYSA-N Synonym: 4-bromo-2,6-xylenol,phenol, 4-bromo-2,6-dimethyl,2,6-dimethyl-4-bromophenol,2,6-xylenol, 4-bromo,pubchem9579,2, 4-bromo,acmc-2097aq,4-bromo-2,6 dimethylphenol,5-bromo-2-hydroxy-m-xylene,ksc495g0d PubChem CID: 16919 IUPAC Name: 4-bromo-2,6-dimethylphenol SMILES: CC1=CC(=CC(=C1O)C)Br

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Specifications

PubChem CID	16919
CAS	2374-05-2
Molecular Weight (g/mol)	201.06
MDL Number	MFCD00002314
SMILES	CC1=CC(=CC(=C1O)C)Br
Synonym	4-bromo-2,6-xylenol,phenol, 4-bromo-2,6-dimethyl,2,6-dimethyl-4-bromophenol,2,6-xylenol, 4-bromo,pubchem9579,2, 4-bromo,acmc-2097aq,4-bromo-2,6 dimethylphenol,5-bromo-2-hydroxy-m-xylene,ksc495g0d
IUPAC Name	4-bromo-2,6-dimethylphenol
InChI Key	ZLVFYUORUHNMBO-UHFFFAOYSA-N
Molecular Formula	C8H9BrO

6,787

2,6-Dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol 98.0+%, TCI America™

CAS: 269410-25-5 Molecular Formula: C14H21BO3 Molecular Weight (g/mol): 248.13 MDL Number: MFCD02093724 InChI Key: TYCKOBOJYNRIBO-UHFFFAOYSA-N Synonym: 2,6-dimethyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,4-hydroxy-3,5-dimethylphenylboronic acid pinacol ester,3,5-dimethyl-4-hydroxyphenylboronic acid pinacol ester,3,5-dimethyl-4-hydroxybenzeneboronic acid, pinacol ester,4-hydroxy-3,5-dimethylphenylboronic acid, pinacol ester,2,6-dimethyl-4-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,2,6-dimethyl-4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-phenol,2,6-dimethyl-4-4,4-5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,2-4-hydroxy-3,5-dimethylphenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,phenol, 2,6-dimethyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl PubChem CID: 2734649 IUPAC Name: 2,6-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol SMILES: CC1=CC(=CC(C)=C1O)B1OC(C)(C)C(C)(C)O1

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Specifications

PubChem CID	2734649
CAS	269410-25-5
Molecular Weight (g/mol)	248.13
MDL Number	MFCD02093724
SMILES	CC1=CC(=CC(C)=C1O)B1OC(C)(C)C(C)(C)O1
Synonym	2,6-dimethyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,4-hydroxy-3,5-dimethylphenylboronic acid pinacol ester,3,5-dimethyl-4-hydroxyphenylboronic acid pinacol ester,3,5-dimethyl-4-hydroxybenzeneboronic acid, pinacol ester,4-hydroxy-3,5-dimethylphenylboronic acid, pinacol ester,2,6-dimethyl-4-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,2,6-dimethyl-4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-phenol,2,6-dimethyl-4-4,4-5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,2-4-hydroxy-3,5-dimethylphenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,phenol, 2,6-dimethyl-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl
IUPAC Name	2,6-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
InChI Key	TYCKOBOJYNRIBO-UHFFFAOYSA-N
Molecular Formula	C14H21BO3

6,788

4-Fluoro-o-cresol 98.0+%, TCI America™

CAS: 452-72-2 Molecular Formula: C7H7FO Molecular Weight (g/mol): 126.13 MDL Number: MFCD00075088 InChI Key: GKQDDKKGDIVDAG-UHFFFAOYSA-N Synonym: 2-methyl-4-fluorophenol,4-fluoro-o-cresol,4-fluoro-2-methyl-phenol,5-fluoro-2-hydroxytoluene,phenol, 4-fluoro-2-methyl,pubchem1500,acmc-1csjj,4-fuoro-2-methyl-phenol,2-methyl-4-fluoro phenol,4-fluoro-2-methyl phenol PubChem CID: 136295 IUPAC Name: 4-fluoro-2-methylphenol SMILES: CC1=C(C=CC(=C1)F)O

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Specifications

PubChem CID	136295
CAS	452-72-2
Molecular Weight (g/mol)	126.13
MDL Number	MFCD00075088
SMILES	CC1=C(C=CC(=C1)F)O
Synonym	2-methyl-4-fluorophenol,4-fluoro-o-cresol,4-fluoro-2-methyl-phenol,5-fluoro-2-hydroxytoluene,phenol, 4-fluoro-2-methyl,pubchem1500,acmc-1csjj,4-fuoro-2-methyl-phenol,2-methyl-4-fluoro phenol,4-fluoro-2-methyl phenol
IUPAC Name	4-fluoro-2-methylphenol
InChI Key	GKQDDKKGDIVDAG-UHFFFAOYSA-N
Molecular Formula	C7H7FO

6,789

2-Methoxy-5-methylphenol 98.0+%, TCI America™

CAS: 1195-09-1 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00040901 InChI Key: IFNDEOYXGHGERA-UHFFFAOYSA-N Synonym: isocreosol,5-methylguaiacol,6-methoxy-m-cresol,isocreosole,phenol, 2-methoxy-5-methyl,2-hydroxy-4-methylanisole,m-cresol, 6-methoxy,2-methoxy-5-methyl-phenol,unii-av5v76ou33,3-hydroxy-4-methoxytoluene PubChem CID: 14519 IUPAC Name: 2-methoxy-5-methylphenol SMILES: CC1=CC(=C(C=C1)OC)O

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PubChem CID	14519
CAS	1195-09-1
Molecular Weight (g/mol)	138.166
MDL Number	MFCD00040901
SMILES	CC1=CC(=C(C=C1)OC)O
Synonym	isocreosol,5-methylguaiacol,6-methoxy-m-cresol,isocreosole,phenol, 2-methoxy-5-methyl,2-hydroxy-4-methylanisole,m-cresol, 6-methoxy,2-methoxy-5-methyl-phenol,unii-av5v76ou33,3-hydroxy-4-methoxytoluene
IUPAC Name	2-methoxy-5-methylphenol
InChI Key	IFNDEOYXGHGERA-UHFFFAOYSA-N
Molecular Formula	C8H10O2

6,790

4-Chloro-3,5-dimethylphenol 98.0+%, TCI America™

CAS: 88-04-0 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.609 MDL Number: MFCD00002324 InChI Key: OSDLLIBGSJNGJE-UHFFFAOYSA-N Synonym: chloroxylenol,dettol,4-chloro-3,5-xylenol,pcmx,benzytol,p-chloro-m-xylenol,2-chloro-m-xylenol,4-chloro-m-xylenol,ottasept,desson PubChem CID: 2723 ChEBI: CHEBI:34393 IUPAC Name: 4-chloro-3,5-dimethylphenol SMILES: CC1=CC(=CC(=C1Cl)C)O

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Specifications

PubChem CID	2723
CAS	88-04-0
Molecular Weight (g/mol)	156.609
ChEBI	CHEBI:34393
MDL Number	MFCD00002324
SMILES	CC1=CC(=CC(=C1Cl)C)O
Synonym	chloroxylenol,dettol,4-chloro-3,5-xylenol,pcmx,benzytol,p-chloro-m-xylenol,2-chloro-m-xylenol,4-chloro-m-xylenol,ottasept,desson
IUPAC Name	4-chloro-3,5-dimethylphenol
InChI Key	OSDLLIBGSJNGJE-UHFFFAOYSA-N
Molecular Formula	C8H9ClO

6,791

4-Bromo-o-cresol 98.0+%, TCI America™

CAS: 2362-12-1 Molecular Formula: C7H7BrO Molecular Weight (g/mol): 187.04 MDL Number: MFCD00055435 InChI Key: IWJGMJHAIUBWKT-UHFFFAOYSA-N Synonym: 4-bromo-o-cresol,2-methyl-4-bromophenol,4-bromo-2-methyl-phenol,o-cresol, 4-bromo,phenol, 4-bromo-2-methyl,2-hydroxy-5-bromotoluene,p-bromocresol,4-bromo-cresol,pubchem7106,acmc-1chy8 PubChem CID: 16896 IUPAC Name: 4-bromo-2-methylphenol SMILES: CC1=C(C=CC(=C1)Br)O

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Specifications

PubChem CID	16896
CAS	2362-12-1
Molecular Weight (g/mol)	187.04
MDL Number	MFCD00055435
SMILES	CC1=C(C=CC(=C1)Br)O
Synonym	4-bromo-o-cresol,2-methyl-4-bromophenol,4-bromo-2-methyl-phenol,o-cresol, 4-bromo,phenol, 4-bromo-2-methyl,2-hydroxy-5-bromotoluene,p-bromocresol,4-bromo-cresol,pubchem7106,acmc-1chy8
IUPAC Name	4-bromo-2-methylphenol
InChI Key	IWJGMJHAIUBWKT-UHFFFAOYSA-N
Molecular Formula	C7H7BrO

6,792

4-Bromotetraphenylsilane 96.0+%, TCI America™

CAS: 18737-40-1 Molecular Formula: C24H19BrSi Molecular Weight (g/mol): 415.405 InChI Key: UDZSLJULKCKKPX-UHFFFAOYSA-N PubChem CID: 297506 IUPAC Name: (4-bromophenyl)-triphenylsilane SMILES: C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)Br

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Specifications

PubChem CID	297506
CAS	18737-40-1
Molecular Weight (g/mol)	415.405
SMILES	C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)Br
IUPAC Name	(4-bromophenyl)-triphenylsilane
InChI Key	UDZSLJULKCKKPX-UHFFFAOYSA-N
Molecular Formula	C24H19BrSi

6,793

2-(3-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborine 98.0+%, TCI America™

CAS: 927384-43-8 Molecular Formula: C16H12BBrN2 Molecular Weight (g/mol): 323 MDL Number: MFCD16038145 InChI Key: RDGOAMRKYXEHHS-UHFFFAOYSA-N Synonym: 3-Bromo-1-(2,3-dihydro-1H-naphtho[1,8-de]-1,3,2-diazaborinyl)benzene, 2-(3-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborinine PubChem CID: 53384412 SMILES: B1(NC2=CC=CC3=C2C(=CC=C3)N1)C4=CC(=CC=C4)Br

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Specifications

PubChem CID	53384412
CAS	927384-43-8
Molecular Weight (g/mol)	323
MDL Number	MFCD16038145
SMILES	B1(NC2=CC=CC3=C2C(=CC=C3)N1)C4=CC(=CC=C4)Br
Synonym	3-Bromo-1-(2,3-dihydro-1H-naphtho[1,8-de]-1,3,2-diazaborinyl)benzene, 2-(3-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborinine
InChI Key	RDGOAMRKYXEHHS-UHFFFAOYSA-N
Molecular Formula	C16H12BBrN2

6,794

5-Bromo-2-fluoroaniline 95.0+%, TCI America™

CAS: 2924-09-6 Molecular Formula: C6H5BrFN Molecular Weight (g/mol): 190.02 MDL Number: MFCD03094181 InChI Key: ADWKOCXRCRSMLQ-UHFFFAOYSA-N Synonym: 5-bromo-2-fluorobenzenamine,2-fluoro-5-bromoaniline,5-bromo-2-fluoro aniline,5-bromo-2-fluorophenylamine,benzenamine, 5-bromo-2-fluoro,5-bromo-2-fluoro-phenylamine,1-amino-5-bromo-2-fluorobenzene,5-bromo-2fluoroaniline,pubchem13482,acmc-1cjje PubChem CID: 2769407 IUPAC Name: 5-bromo-2-fluoroaniline SMILES: C1=CC(=C(C=C1Br)N)F

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Specifications

PubChem CID	2769407
CAS	2924-09-6
Molecular Weight (g/mol)	190.02
MDL Number	MFCD03094181
SMILES	C1=CC(=C(C=C1Br)N)F
Synonym	5-bromo-2-fluorobenzenamine,2-fluoro-5-bromoaniline,5-bromo-2-fluoro aniline,5-bromo-2-fluorophenylamine,benzenamine, 5-bromo-2-fluoro,5-bromo-2-fluoro-phenylamine,1-amino-5-bromo-2-fluorobenzene,5-bromo-2fluoroaniline,pubchem13482,acmc-1cjje
IUPAC Name	5-bromo-2-fluoroaniline
InChI Key	ADWKOCXRCRSMLQ-UHFFFAOYSA-N
Molecular Formula	C6H5BrFN

6,795

Tetrakis(4-bromophenyl)methane 95.0+%, TCI America™

CAS: 105309-59-9 Molecular Formula: C25H16Br4 Molecular Weight (g/mol): 636.019 MDL Number: MFCD19688472 InChI Key: YBGIIZGNEOJSRF-UHFFFAOYSA-N PubChem CID: 11250692 IUPAC Name: 1-bromo-4-[tris(4-bromophenyl)methyl]benzene SMILES: C1=CC(=CC=C1C(C2=CC=C(C=C2)Br)(C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Br)Br

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Specifications

PubChem CID	11250692
CAS	105309-59-9
Molecular Weight (g/mol)	636.019
MDL Number	MFCD19688472
SMILES	C1=CC(=CC=C1C(C2=CC=C(C=C2)Br)(C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Br)Br
IUPAC Name	1-bromo-4-[tris(4-bromophenyl)methyl]benzene
InChI Key	YBGIIZGNEOJSRF-UHFFFAOYSA-N
Molecular Formula	C25H16Br4

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