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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 (129,842)
Phenols (24,890)
Naphthalenes (6,294)
Phenol esters (4,685)
Unsubstituted Phenols (1,453)
Fluorenes (1,297)
Thiophenols (748)
Anthracenes (509)
Indanes (489)
Phenanthrenes and derivatives (364)
Tetralins (340)
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Triphenyl compounds (280)
Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (17)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (5)

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Keyword Search:
541 – 555 of 158,383 results
541

2,5-Difluoroaniline 98.0+%, TCI America™

CAS: 367-30-6 Molecular Formula: C6H5F2N Molecular Weight (g/mol): 129.11 MDL Number: MFCD00007651 InChI Key: YNOOQIUSYGWMSS-UHFFFAOYSA-N Synonym: benzenamine, 2,5-difluoro,2,5-difluorobenzenamine,2,5-difluoro-phenylamine,aniline, 2,5-difluoro,2.5-difluoroaniline,aniline,5-difluoro,pubchem1531,2,5-difluoro-aniline,2,5-difluorophenylamine,benzenamine,5-difluoro PubChem CID: 67775 IUPAC Name: 2,5-difluoroaniline SMILES: C1=CC(=C(C=C1F)N)F

PubChem CID 67775
CAS 367-30-6
Molecular Weight (g/mol) 129.11
MDL Number MFCD00007651
SMILES C1=CC(=C(C=C1F)N)F
Synonym benzenamine, 2,5-difluoro,2,5-difluorobenzenamine,2,5-difluoro-phenylamine,aniline, 2,5-difluoro,2.5-difluoroaniline,aniline,5-difluoro,pubchem1531,2,5-difluoro-aniline,2,5-difluorophenylamine,benzenamine,5-difluoro
IUPAC Name 2,5-difluoroaniline
InChI Key YNOOQIUSYGWMSS-UHFFFAOYSA-N
Molecular Formula C6H5F2N
542

Fluconazole 98.0+%, TCI America™

CAS: 86386-73-4 Molecular Formula: C13H12F2N6O Molecular Weight (g/mol): 306.277 InChI Key: RFHAOTPXVQNOHP-UHFFFAOYSA-N Synonym: fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol PubChem CID: 3365 ChEBI: CHEBI:46081 IUPAC Name: 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol SMILES: C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O

PubChem CID 3365
CAS 86386-73-4
Molecular Weight (g/mol) 306.277
ChEBI CHEBI:46081
SMILES C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O
Synonym fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol
IUPAC Name 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol
InChI Key RFHAOTPXVQNOHP-UHFFFAOYSA-N
Molecular Formula C13H12F2N6O
543

2-Methyl-6-nitrobenzoic Anhydride 98.0+%, TCI America™

CAS: 434935-69-0 Molecular Formula: C16H12N2O7 Molecular Weight (g/mol): 344.279 MDL Number: MFCD06797117 InChI Key: YEKPNMQQSPHKBP-UHFFFAOYSA-N Synonym: 6-Nitro-o-toluic Anhydride, MNBA PubChem CID: 10472648 IUPAC Name: (2-methyl-6-nitrobenzoyl) 2-methyl-6-nitrobenzoate SMILES: CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OC(=O)C2=C(C=CC=C2[N+](=O)[O-])C

PubChem CID 10472648
CAS 434935-69-0
Molecular Weight (g/mol) 344.279
MDL Number MFCD06797117
SMILES CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OC(=O)C2=C(C=CC=C2[N+](=O)[O-])C
Synonym 6-Nitro-o-toluic Anhydride, MNBA
IUPAC Name (2-methyl-6-nitrobenzoyl) 2-methyl-6-nitrobenzoate
InChI Key YEKPNMQQSPHKBP-UHFFFAOYSA-N
Molecular Formula C16H12N2O7
544

2,4,4'-Trichloro-2'-hydroxydiphenyl Ether 98.0+%, TCI America™

CAS: 3380-34-5 Molecular Formula: C12H7Cl3O2 Molecular Weight (g/mol): 289.536 MDL Number: MFCD00800992 InChI Key: XEFQLINVKFYRCS-UHFFFAOYSA-N Synonym: triclosan,5-chloro-2-2,4-dichlorophenoxy phenol,irgasan,2,4,4'-trichloro-2'-hydroxydiphenyl ether,cloxifenolum,triclosanum,irgasan dp300,stri-dex face wash,aquasept,sapoderm PubChem CID: 5564 ChEBI: CHEBI:164200 IUPAC Name: 5-chloro-2-(2,4-dichlorophenoxy)phenol SMILES: C1=CC(=C(C=C1Cl)O)OC2=C(C=C(C=C2)Cl)Cl

PubChem CID 5564
CAS 3380-34-5
Molecular Weight (g/mol) 289.536
ChEBI CHEBI:164200
MDL Number MFCD00800992
SMILES C1=CC(=C(C=C1Cl)O)OC2=C(C=C(C=C2)Cl)Cl
Synonym triclosan,5-chloro-2-2,4-dichlorophenoxy phenol,irgasan,2,4,4'-trichloro-2'-hydroxydiphenyl ether,cloxifenolum,triclosanum,irgasan dp300,stri-dex face wash,aquasept,sapoderm
IUPAC Name 5-chloro-2-(2,4-dichlorophenoxy)phenol
InChI Key XEFQLINVKFYRCS-UHFFFAOYSA-N
Molecular Formula C12H7Cl3O2
545

Bis[2-(diphenylphosphino)phenyl] Ether 98.0+%, TCI America™

CAS: 166330-10-5 Molecular Formula: C36H28OP2 Molecular Weight (g/mol): 538.57 MDL Number: MFCD00233863 InChI Key: RYXZOQOZERSHHQ-UHFFFAOYSA-N Synonym: bis 2-diphenylphosphinophenyl ether,dpephos,oxydi-2,1-phenylene bis diphenylphosphine,oxybis 2,1-phenylene bis diphenylphosphine,bis 2-diphenylphosphino phenyl ether,2,2'-bis diphenylphosphino diphenyl ether,2-2-diphenylphosphanyl phenoxy phenyl diphenylphosphane PubChem CID: 4285986 IUPAC Name: {2-[2-(diphenylphosphanyl)phenoxy]phenyl}diphenylphosphane SMILES: O(C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 4285986
CAS 166330-10-5
Molecular Weight (g/mol) 538.57
MDL Number MFCD00233863
SMILES O(C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1
Synonym bis 2-diphenylphosphinophenyl ether,dpephos,oxydi-2,1-phenylene bis diphenylphosphine,oxybis 2,1-phenylene bis diphenylphosphine,bis 2-diphenylphosphino phenyl ether,2,2'-bis diphenylphosphino diphenyl ether,2-2-diphenylphosphanyl phenoxy phenyl diphenylphosphane
IUPAC Name {2-[2-(diphenylphosphanyl)phenoxy]phenyl}diphenylphosphane
InChI Key RYXZOQOZERSHHQ-UHFFFAOYSA-N
Molecular Formula C36H28OP2
546

9,10-Dihydroanthracene 98.0+%, TCI America™

CAS: 613-31-0 Molecular Formula: C14H12 Molecular Weight (g/mol): 180.25 MDL Number: MFCD00001239 InChI Key: WPDAVTSOEQEGMS-UHFFFAOYSA-N Synonym: anthracene, 9,10-dihydro,anthracene, dihydro,9,10-dihydro-anthracene,unii-z142c238gb,anthracene,10-dihydro,acmc-1bh69,9,10-dihydroanthracen-9-yl,9,10-dihydroanthracene PubChem CID: 11940 IUPAC Name: 9,10-dihydroanthracene SMILES: C1C2=CC=CC=C2CC3=CC=CC=C31

PubChem CID 11940
CAS 613-31-0
Molecular Weight (g/mol) 180.25
MDL Number MFCD00001239
SMILES C1C2=CC=CC=C2CC3=CC=CC=C31
Synonym anthracene, 9,10-dihydro,anthracene, dihydro,9,10-dihydro-anthracene,unii-z142c238gb,anthracene,10-dihydro,acmc-1bh69,9,10-dihydroanthracen-9-yl,9,10-dihydroanthracene
IUPAC Name 9,10-dihydroanthracene
InChI Key WPDAVTSOEQEGMS-UHFFFAOYSA-N
Molecular Formula C14H12
547

2-Bromocumene 97.0+%, TCI America™

CAS: 7073-94-1 Molecular Formula: C9H11Br Molecular Weight (g/mol): 199.091 MDL Number: MFCD00051567 InChI Key: LECYCYNAEJDSIL-UHFFFAOYSA-N Synonym: 1-bromo-2-isopropylbenzene,1-bromo-2-1-methylethyl benzene,2-isopropylbromobenzene,o-bromocumene,2-bromocumene,2-bromo cumene,cumene, o-bromo,benzene, 1-bromo-2-1-methylethyl,1-bromo-2-propan-2-yl benzene,1-bromo-2-isopropyl benzene PubChem CID: 23475 IUPAC Name: 1-bromo-2-propan-2-ylbenzene SMILES: CC(C)C1=CC=CC=C1Br

PubChem CID 23475
CAS 7073-94-1
Molecular Weight (g/mol) 199.091
MDL Number MFCD00051567
SMILES CC(C)C1=CC=CC=C1Br
Synonym 1-bromo-2-isopropylbenzene,1-bromo-2-1-methylethyl benzene,2-isopropylbromobenzene,o-bromocumene,2-bromocumene,2-bromo cumene,cumene, o-bromo,benzene, 1-bromo-2-1-methylethyl,1-bromo-2-propan-2-yl benzene,1-bromo-2-isopropyl benzene
IUPAC Name 1-bromo-2-propan-2-ylbenzene
InChI Key LECYCYNAEJDSIL-UHFFFAOYSA-N
Molecular Formula C9H11Br
548

4-Chlorobenzhydrol 98.0+%, TCI America™

CAS: 119-56-2 Molecular Formula: C13H11ClO Molecular Weight (g/mol): 218.68 MDL Number: MFCD00004491 InChI Key: AJYOOHCNOXWTKJ-UHFFFAOYSA-N Synonym: 4-chlorobenzhydrol,4-chlorophenyl phenyl methanol,p-chlorobenzhydrol,chlorobenzhydrol,benzhydrol, p-chloro,4-chlorodiphenylmethanol,benzhydrol, 4-chloro,4-chlorophenyl phenylmethanol,4-chlorobenzhydryl alcohol,benzenemethanol, 4-chloro-.alpha.-phenyl PubChem CID: 8401 ChEBI: CHEBI:35091 IUPAC Name: (4-chlorophenyl)-phenylmethanol SMILES: C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)O

PubChem CID 8401
CAS 119-56-2
Molecular Weight (g/mol) 218.68
ChEBI CHEBI:35091
MDL Number MFCD00004491
SMILES C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)O
Synonym 4-chlorobenzhydrol,4-chlorophenyl phenyl methanol,p-chlorobenzhydrol,chlorobenzhydrol,benzhydrol, p-chloro,4-chlorodiphenylmethanol,benzhydrol, 4-chloro,4-chlorophenyl phenylmethanol,4-chlorobenzhydryl alcohol,benzenemethanol, 4-chloro-.alpha.-phenyl
IUPAC Name (4-chlorophenyl)-phenylmethanol
InChI Key AJYOOHCNOXWTKJ-UHFFFAOYSA-N
Molecular Formula C13H11ClO
549

4-Fluorobenzophenone 99.0+%, TCI America™

CAS: 345-83-5 Molecular Formula: C13H9FO Molecular Weight (g/mol): 200.21 MDL Number: MFCD00000352 InChI Key: OGTSHGYHILFRHD-UHFFFAOYSA-N Synonym: 4-fluorobenzophenone,4-fluorophenyl phenyl methanone,p-fluorobenzophenone,methanone, 4-fluorophenyl phenyl,4-fluorophenyl phenyl ketone,4-fluorophenyl-phenylmethanone,4'-fluorobenzophenone,4-fluoro-benzophenone,pubchem3308,benzophenone, 4-fluoro PubChem CID: 67663 IUPAC Name: (4-fluorophenyl)(phenyl)methanone SMILES: FC1=CC=C(C=C1)C(=O)C1=CC=CC=C1

PubChem CID 67663
CAS 345-83-5
Molecular Weight (g/mol) 200.21
MDL Number MFCD00000352
SMILES FC1=CC=C(C=C1)C(=O)C1=CC=CC=C1
Synonym 4-fluorobenzophenone,4-fluorophenyl phenyl methanone,p-fluorobenzophenone,methanone, 4-fluorophenyl phenyl,4-fluorophenyl phenyl ketone,4-fluorophenyl-phenylmethanone,4'-fluorobenzophenone,4-fluoro-benzophenone,pubchem3308,benzophenone, 4-fluoro
IUPAC Name (4-fluorophenyl)(phenyl)methanone
InChI Key OGTSHGYHILFRHD-UHFFFAOYSA-N
Molecular Formula C13H9FO
550

1-Naphthol 98.0+%, TCI America™

CAS: 90-15-3 Molecular Formula: C10H8O Molecular Weight (g/mol): 144.173 MDL Number: MFCD00003930 InChI Key: KJCVRFUGPWSIIH-UHFFFAOYSA-N Synonym: 1-naphthol,1-naphthalenol,alpha-naphthol,1-hydroxynaphthalene,naphthol,fouramine ern,fourrine ern,tertral ern,furro er,basf ursol ern PubChem CID: 7005 ChEBI: CHEBI:10319 IUPAC Name: naphthalen-1-ol SMILES: C1=CC=C2C(=C1)C=CC=C2O

PubChem CID 7005
CAS 90-15-3
Molecular Weight (g/mol) 144.173
ChEBI CHEBI:10319
MDL Number MFCD00003930
SMILES C1=CC=C2C(=C1)C=CC=C2O
Synonym 1-naphthol,1-naphthalenol,alpha-naphthol,1-hydroxynaphthalene,naphthol,fouramine ern,fourrine ern,tertral ern,furro er,basf ursol ern
IUPAC Name naphthalen-1-ol
InChI Key KJCVRFUGPWSIIH-UHFFFAOYSA-N
Molecular Formula C10H8O
551

4,4'-Dimethylbenzophenone 99.0+%, TCI America™

CAS: 611-97-2 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.276 MDL Number: MFCD00017214 InChI Key: ZWPWLKXZYNXATK-UHFFFAOYSA-N Synonym: 4,4'-dimethylbenzophenone,p-tolyl ketone,bis 4-methylphenyl methanone,di-p-tolyl ketone,methanone, bis 4-methylphenyl,p,p'-dimethylbenzophenone,p,p'-dimethyl di-phenyl ketone,bis-p-tolylmethanone,benzophenone, 4,4'-dimethyl,4,4-dimethylbenzophenone PubChem CID: 69148 IUPAC Name: bis(4-methylphenyl)methanone SMILES: CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C

PubChem CID 69148
CAS 611-97-2
Molecular Weight (g/mol) 210.276
MDL Number MFCD00017214
SMILES CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C
Synonym 4,4'-dimethylbenzophenone,p-tolyl ketone,bis 4-methylphenyl methanone,di-p-tolyl ketone,methanone, bis 4-methylphenyl,p,p'-dimethylbenzophenone,p,p'-dimethyl di-phenyl ketone,bis-p-tolylmethanone,benzophenone, 4,4'-dimethyl,4,4-dimethylbenzophenone
IUPAC Name bis(4-methylphenyl)methanone
InChI Key ZWPWLKXZYNXATK-UHFFFAOYSA-N
Molecular Formula C15H14O
552

Resorcinol 99.0+%, TCI America™

CAS: 108-46-3 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD00002269 InChI Key: GHMLBKRAJCXXBS-UHFFFAOYSA-N Synonym: 1,3-Dihydroxybenzene PubChem CID: 5054 ChEBI: CHEBI:27810 IUPAC Name: benzene-1,3-diol SMILES: C1=CC(=CC(=C1)O)O

PubChem CID 5054
CAS 108-46-3
Molecular Weight (g/mol) 110.112
ChEBI CHEBI:27810
MDL Number MFCD00002269
SMILES C1=CC(=CC(=C1)O)O
Synonym 1,3-Dihydroxybenzene
IUPAC Name benzene-1,3-diol
InChI Key GHMLBKRAJCXXBS-UHFFFAOYSA-N
Molecular Formula C6H6O2
553

Thiobenzoic Acid 93.0+%, TCI America™

CAS: 98-91-9 Molecular Formula: C7H6OS Molecular Weight (g/mol): 138.184 MDL Number: MFCD00004852 InChI Key: UIJGNTRUPZPVNG-UHFFFAOYSA-N Synonym: thiobenzoic acid,benzenecarbothioic acid,benzoyl thiol,monothiobenzoic acid,benzoic acid, thio,acido mercaptobenzoico,unii-gbg5rlo56n,ccris 8913,acido mercaptobenzoico italian,gbg5rlo56n PubChem CID: 7414 IUPAC Name: benzenecarbothioic S-acid SMILES: C1=CC=C(C=C1)C(=O)S

PubChem CID 7414
CAS 98-91-9
Molecular Weight (g/mol) 138.184
MDL Number MFCD00004852
SMILES C1=CC=C(C=C1)C(=O)S
Synonym thiobenzoic acid,benzenecarbothioic acid,benzoyl thiol,monothiobenzoic acid,benzoic acid, thio,acido mercaptobenzoico,unii-gbg5rlo56n,ccris 8913,acido mercaptobenzoico italian,gbg5rlo56n
IUPAC Name benzenecarbothioic S-acid
InChI Key UIJGNTRUPZPVNG-UHFFFAOYSA-N
Molecular Formula C7H6OS
554

4-(tert-Butyl)phenyl isocyanate, 97%, Thermo Scientific™

CAS: 1943-67-5 Molecular Formula: C11H13NO Molecular Weight (g/mol): 175.231 MDL Number: MFCD00040718 InChI Key: WUWBDQJTQTVBSQ-UHFFFAOYSA-N Synonym: 4-tert-butylphenyl isocyanate,4-tert-butylphenylisocyanate,benzene, 1-1,1-dimethylethyl-4-isocyanato,4-tert-butylphenyl-isocyanate,4-tert-butyl phenyl isocyanate,1-tert-butyl-4-isocyanato-benzene,benzene,1-1,1-dimethylethyl-4-isocyanato,4-t-butylphenylisocyanate,acmc-209ey5,4-tertbutylphenyl isocyanate PubChem CID: 2735695 IUPAC Name: 1-tert-butyl-4-isocyanatobenzene SMILES: CC(C)(C)C1=CC=C(C=C1)N=C=O

PubChem CID 2735695
CAS 1943-67-5
Molecular Weight (g/mol) 175.231
MDL Number MFCD00040718
SMILES CC(C)(C)C1=CC=C(C=C1)N=C=O
Synonym 4-tert-butylphenyl isocyanate,4-tert-butylphenylisocyanate,benzene, 1-1,1-dimethylethyl-4-isocyanato,4-tert-butylphenyl-isocyanate,4-tert-butyl phenyl isocyanate,1-tert-butyl-4-isocyanato-benzene,benzene,1-1,1-dimethylethyl-4-isocyanato,4-t-butylphenylisocyanate,acmc-209ey5,4-tertbutylphenyl isocyanate
IUPAC Name 1-tert-butyl-4-isocyanatobenzene
InChI Key WUWBDQJTQTVBSQ-UHFFFAOYSA-N
Molecular Formula C11H13NO
555

3-[3-(Chloromethyl)phenoxy]-N,N-dimethylpropylamine hydrochloride, 95%, Thermo Scientific™

CAS: 926921-62-2 Molecular Formula: C12H19Cl2NO Molecular Weight (g/mol): 264.19 MDL Number: MFCD09702394 InChI Key: MCRYCZSEVCPYAW-UHFFFAOYSA-N Synonym: 3-3-chloromethyl phenoxy-n,n-dimethylpropylamine hydrochloride,3-3-dimethylamino propoxy benzyl chloride hydrochloride,3-3-chloromethyl phenoxy propyl dimethylamine hydrochloride,3-3-chloromethyl phenoxy propyl dimethylamine, chloride,3-3-chloromethyl phenoxy-n,n-dimethylpropan-1-amine hydrochloride,1-propanamine,3-3-chloromethyl phenoxy-n,n-dimethyl-,hydrochloride 1:1,3-3-chloromethyl phenoxy-n,n-dimethylpropan-1-amine-hydrogen chloride 1/1 PubChem CID: 24229607 SMILES: Cl.CN(C)CCCOC1=CC=CC(CCl)=C1

PubChem CID 24229607
CAS 926921-62-2
Molecular Weight (g/mol) 264.19
MDL Number MFCD09702394
SMILES Cl.CN(C)CCCOC1=CC=CC(CCl)=C1
Synonym 3-3-chloromethyl phenoxy-n,n-dimethylpropylamine hydrochloride,3-3-dimethylamino propoxy benzyl chloride hydrochloride,3-3-chloromethyl phenoxy propyl dimethylamine hydrochloride,3-3-chloromethyl phenoxy propyl dimethylamine, chloride,3-3-chloromethyl phenoxy-n,n-dimethylpropan-1-amine hydrochloride,1-propanamine,3-3-chloromethyl phenoxy-n,n-dimethyl-,hydrochloride 1:1,3-3-chloromethyl phenoxy-n,n-dimethylpropan-1-amine-hydrogen chloride 1/1
InChI Key MCRYCZSEVCPYAW-UHFFFAOYSA-N
Molecular Formula C12H19Cl2NO