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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 (68,133)
Phenols (13,712)
Naphthalenes (5,120)
Fluorenes (1,235)
Unsubstituted Phenols (1,166)
Thiophenols (617)
Phenol esters (564)
Anthracenes (419)
Tetralins (333)
Phenanthrenes and derivatives (332)
Indanes (313)
Triphenyl compounds (277)
Pyrenes (229)
Dibenzocycloheptenes (62)
Naphthacenes (36)
Ellagic acids and derivatives (33)
Pentacenes (19)
Pentacenequinones (16)
Acenaphthylenes (15)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (6)

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11,056 – 11,070 of 79,319 results
11,056

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

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
11,057

Calix[6]arene 95.0+%, TCI America™

CAS: 96107-95-8 Molecular Formula: C42H36O6 Molecular Weight (g/mol): 636.744 MDL Number: MFCD00143083 InChI Key: JLSWUKWFQCVKCL-UHFFFAOYSA-N Synonym: calix 6 arene,hexahydroxycalix 6 arene PubChem CID: 2724885 SMILES: C1C2=C(C(=CC=C2)CC3=C(C(=CC=C3)CC4=C(C(=CC=C4)CC5=CC=CC(=C5O)CC6=CC=CC(=C6O)CC7=CC=CC1=C7O)O)O)O

PubChem CID 2724885
CAS 96107-95-8
Molecular Weight (g/mol) 636.744
MDL Number MFCD00143083
SMILES C1C2=C(C(=CC=C2)CC3=C(C(=CC=C3)CC4=C(C(=CC=C4)CC5=CC=CC(=C5O)CC6=CC=CC(=C6O)CC7=CC=CC1=C7O)O)O)O
Synonym calix 6 arene,hexahydroxycalix 6 arene
InChI Key JLSWUKWFQCVKCL-UHFFFAOYSA-N
Molecular Formula C42H36O6
11,058

Etilefrine Hydrochloride 98.0+%, TCI America™

CAS: 943-17-9 Molecular Formula: C10H16ClNO2 Molecular Weight (g/mol): 217.69 MDL Number: MFCD00060167 InChI Key: KTNROWWHOBZQGK-UHFFFAOYNA-N Synonym: 2-Ethylamino-1-(3-hydroxyphenyl)ethanol Hydrochloride PubChem CID: 164652 IUPAC Name: hydrogen 3-[2-(ethylamino)-1-hydroxyethyl]phenol chloride SMILES: [H+].[Cl-].CCNCC(O)C1=CC=CC(O)=C1

PubChem CID 164652
CAS 943-17-9
Molecular Weight (g/mol) 217.69
MDL Number MFCD00060167
SMILES [H+].[Cl-].CCNCC(O)C1=CC=CC(O)=C1
Synonym 2-Ethylamino-1-(3-hydroxyphenyl)ethanol Hydrochloride
IUPAC Name hydrogen 3-[2-(ethylamino)-1-hydroxyethyl]phenol chloride
InChI Key KTNROWWHOBZQGK-UHFFFAOYNA-N
Molecular Formula C10H16ClNO2
11,059

2-Phenylpropionaldehyde 95.0+%, TCI America™

CAS: 93-53-8 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.178 MDL Number: MFCD00006973 InChI Key: IQVAERDLDAZARL-UHFFFAOYSA-N Synonym: 2-phenylpropionaldehyde,hydratropaldehyde,hydratropic aldehyde,hyacinthal,cumene aldehyde,hydratropa aldehyde,hydrotropic aldehyde,2-phenyl-1-propanal,2-phenyl propionaldehyde,aldehyd hydratropovy PubChem CID: 7146 IUPAC Name: 2-phenylpropanal SMILES: CC(C=O)C1=CC=CC=C1

PubChem CID 7146
CAS 93-53-8
Molecular Weight (g/mol) 134.178
MDL Number MFCD00006973
SMILES CC(C=O)C1=CC=CC=C1
Synonym 2-phenylpropionaldehyde,hydratropaldehyde,hydratropic aldehyde,hyacinthal,cumene aldehyde,hydratropa aldehyde,hydrotropic aldehyde,2-phenyl-1-propanal,2-phenyl propionaldehyde,aldehyd hydratropovy
IUPAC Name 2-phenylpropanal
InChI Key IQVAERDLDAZARL-UHFFFAOYSA-N
Molecular Formula C9H10O
11,060

Phenylacetaldehyde (40-55% in Diethyl Phthalate), TCI America™

CAS: 122-78-1 Molecular Formula: C8H8O Molecular Weight (g/mol): 120.15 MDL Number: MFCD00006993 InChI Key: DTUQWGWMVIHBKE-UHFFFAOYSA-N Synonym: phenylacetaldehyde,benzeneacetaldehyde,hyacinthin,alpha-tolualdehyde,phenylethanal,2-phenylethanal,phenylacetic aldehyde,alpha-toluic aldehyde,acetaldehyde, phenyl,benzylcarboxaldehyde PubChem CID: 998 ChEBI: CHEBI:16424 IUPAC Name: 2-phenylacetaldehyde SMILES: O=CCC1=CC=CC=C1

PubChem CID 998
CAS 122-78-1
Molecular Weight (g/mol) 120.15
ChEBI CHEBI:16424
MDL Number MFCD00006993
SMILES O=CCC1=CC=CC=C1
Synonym phenylacetaldehyde,benzeneacetaldehyde,hyacinthin,alpha-tolualdehyde,phenylethanal,2-phenylethanal,phenylacetic aldehyde,alpha-toluic aldehyde,acetaldehyde, phenyl,benzylcarboxaldehyde
IUPAC Name 2-phenylacetaldehyde
InChI Key DTUQWGWMVIHBKE-UHFFFAOYSA-N
Molecular Formula C8H8O
11,061

Methyl Thiosalicylate 98.0+%, TCI America™

CAS: 4892-02-8 Molecular Formula: C8H8O2S Molecular Weight (g/mol): 168.21 MDL Number: MFCD00060678 InChI Key: BAQGCWNPCFABAY-UHFFFAOYSA-N Synonym: methyl thiosalicylate,methyl 2-mercaptobenzoate,methyl o-mercaptobenzoate,usaf ma-15,benzoic acid, 2-mercapto-, methyl ester,methyl-o-mercaptobenzoate,methyl-2-mercaptobenzoate,benzoic acid, o-mercapto-, methyl ester,2-methoxycarbonyl thiophenol,2-mercaptobenzoic acid methyl ester PubChem CID: 21009 IUPAC Name: methyl 2-sulfanylbenzoate SMILES: COC(=O)C1=CC=CC=C1S

PubChem CID 21009
CAS 4892-02-8
Molecular Weight (g/mol) 168.21
MDL Number MFCD00060678
SMILES COC(=O)C1=CC=CC=C1S
Synonym methyl thiosalicylate,methyl 2-mercaptobenzoate,methyl o-mercaptobenzoate,usaf ma-15,benzoic acid, 2-mercapto-, methyl ester,methyl-o-mercaptobenzoate,methyl-2-mercaptobenzoate,benzoic acid, o-mercapto-, methyl ester,2-methoxycarbonyl thiophenol,2-mercaptobenzoic acid methyl ester
IUPAC Name methyl 2-sulfanylbenzoate
InChI Key BAQGCWNPCFABAY-UHFFFAOYSA-N
Molecular Formula C8H8O2S
11,062

2,3,5,6-Tetrafluoro-4-mercaptobenzoic Acid 98.0+%, TCI America™

CAS: 5211-44-9 Molecular Formula: C7H2F4O2S Molecular Weight (g/mol): 226.14 MDL Number: MFCD00129954 InChI Key: USFMEWZQIHKRDP-UHFFFAOYSA-N PubChem CID: 297543 IUPAC Name: 2,3,5,6-tetrafluoro-4-sulfanylbenzoic acid SMILES: OC(=O)C1=C(F)C(F)=C(S)C(F)=C1F

PubChem CID 297543
CAS 5211-44-9
Molecular Weight (g/mol) 226.14
MDL Number MFCD00129954
SMILES OC(=O)C1=C(F)C(F)=C(S)C(F)=C1F
IUPAC Name 2,3,5,6-tetrafluoro-4-sulfanylbenzoic acid
InChI Key USFMEWZQIHKRDP-UHFFFAOYSA-N
Molecular Formula C7H2F4O2S
11,063

3-Hydroxybenzotrifluoride 98.0+%, TCI America™

CAS: 98-17-9 Molecular Formula: C7H5F3O Molecular Weight (g/mol): 162.111 MDL Number: MFCD00002299 InChI Key: UGEJOEBBMPOJMT-UHFFFAOYSA-N Synonym: 3-trifluoromethyl phenol,3-hydroxybenzotrifluoride,m-trifluoromethylphenol,m-hydroxybenzotrifluoride,phenol, 3-trifluoromethyl,m-trifluoromethyl phenol,alpha,alpha,alpha-trifluoro-m-cresol,a,a,a-trifluoro-m-cresol PubChem CID: 7376 IUPAC Name: 3-(trifluoromethyl)phenol SMILES: C1=CC(=CC(=C1)O)C(F)(F)F

PubChem CID 7376
CAS 98-17-9
Molecular Weight (g/mol) 162.111
MDL Number MFCD00002299
SMILES C1=CC(=CC(=C1)O)C(F)(F)F
Synonym 3-trifluoromethyl phenol,3-hydroxybenzotrifluoride,m-trifluoromethylphenol,m-hydroxybenzotrifluoride,phenol, 3-trifluoromethyl,m-trifluoromethyl phenol,alpha,alpha,alpha-trifluoro-m-cresol,a,a,a-trifluoro-m-cresol
IUPAC Name 3-(trifluoromethyl)phenol
InChI Key UGEJOEBBMPOJMT-UHFFFAOYSA-N
Molecular Formula C7H5F3O
11,064

2-Fluorobenzotrifluoride 98.0+%, TCI America™

CAS: 392-85-8 Molecular Formula: C7H4F4 Molecular Weight (g/mol): 164.103 MDL Number: MFCD00000374 InChI Key: BGVGHYOIWIALFF-UHFFFAOYSA-N Synonym: 2-fluorobenzotrifluoride,1-fluoro-2-trifluoromethyl benzene,o-fluorobenzotrifluoride,benzene, 1-fluoro-2-trifluoromethyl,alpha,alpha,alpha,2-tetrafluorotoluene,benzene, fluoro trifluoromethyl,o,alpha,alpha,alpha-tetrafluorotoluene,a,a,a,2-tetrafluorotoluene,alpha,alpha,alpha,ar-tetrafluorotoluene,2-trifluoromethyl fluorobenzene PubChem CID: 9807 IUPAC Name: 1-fluoro-2-(trifluoromethyl)benzene SMILES: C1=CC=C(C(=C1)C(F)(F)F)F

PubChem CID 9807
CAS 392-85-8
Molecular Weight (g/mol) 164.103
MDL Number MFCD00000374
SMILES C1=CC=C(C(=C1)C(F)(F)F)F
Synonym 2-fluorobenzotrifluoride,1-fluoro-2-trifluoromethyl benzene,o-fluorobenzotrifluoride,benzene, 1-fluoro-2-trifluoromethyl,alpha,alpha,alpha,2-tetrafluorotoluene,benzene, fluoro trifluoromethyl,o,alpha,alpha,alpha-tetrafluorotoluene,a,a,a,2-tetrafluorotoluene,alpha,alpha,alpha,ar-tetrafluorotoluene,2-trifluoromethyl fluorobenzene
IUPAC Name 1-fluoro-2-(trifluoromethyl)benzene
InChI Key BGVGHYOIWIALFF-UHFFFAOYSA-N
Molecular Formula C7H4F4
11,065

2-Amino-5-fluorobenzotrifluoride 97.0+%, TCI America™

CAS: 393-39-5 Molecular Formula: C7H5F4N Molecular Weight (g/mol): 179.12 MDL Number: MFCD00007831 InChI Key: LRCQLCWUUBSUOY-UHFFFAOYSA-N Synonym: 2-amino-5-fluorobenzotrifluoride,4-fluoro-2-trifluoromethyl aniline,4-fluoro-2-trifluoromethyl-phenylamine,benzenamine, 4-fluoro-2-trifluoromethyl,alpha,alpha,alpha,4-tetrafluoro-o-toluidine,alpha,2-amino-5-fluoro benzotrifluoride,4-fluoro-2-trifluoromethyl phenylamine,alpha,alpha,alpha-4-tetrafluoro-o-toluidine,benzenamine,4-fluoro-2-trifluoromethyl PubChem CID: 67853 IUPAC Name: 4-fluoro-2-(trifluoromethyl)aniline SMILES: NC1=CC=C(F)C=C1C(F)(F)F

PubChem CID 67853
CAS 393-39-5
Molecular Weight (g/mol) 179.12
MDL Number MFCD00007831
SMILES NC1=CC=C(F)C=C1C(F)(F)F
Synonym 2-amino-5-fluorobenzotrifluoride,4-fluoro-2-trifluoromethyl aniline,4-fluoro-2-trifluoromethyl-phenylamine,benzenamine, 4-fluoro-2-trifluoromethyl,alpha,alpha,alpha,4-tetrafluoro-o-toluidine,alpha,2-amino-5-fluoro benzotrifluoride,4-fluoro-2-trifluoromethyl phenylamine,alpha,alpha,alpha-4-tetrafluoro-o-toluidine,benzenamine,4-fluoro-2-trifluoromethyl
IUPAC Name 4-fluoro-2-(trifluoromethyl)aniline
InChI Key LRCQLCWUUBSUOY-UHFFFAOYSA-N
Molecular Formula C7H5F4N
11,066

2-Chloro-5-(trifluoromethyl)benzonitrile 98.0+%, TCI America™

CAS: 328-87-0 Molecular Formula: C8H3ClF3N Molecular Weight (g/mol): 205.564 InChI Key: LCISFYAQKHOWBP-UHFFFAOYSA-N Synonym: 2-chloro-5-trifluoromethyl benzonitrile,benzonitrile, 2-chloro-5-trifluoromethyl,4-chloro-3-cyanobenzotrifluoride,4-chloro-3-cyanobenzo trifluoride,4-chloro-3-cyanbenzotrifluoride,2-chloro-5-trifluoromethyl benzenecarbonitrile,ncr bg exfff,pubchem4749,acmc-1cq7c,ksc494q7d PubChem CID: 67604 IUPAC Name: 2-chloro-5-(trifluoromethyl)benzonitrile SMILES: C1=CC(=C(C=C1C(F)(F)F)C#N)Cl

PubChem CID 67604
CAS 328-87-0
Molecular Weight (g/mol) 205.564
SMILES C1=CC(=C(C=C1C(F)(F)F)C#N)Cl
Synonym 2-chloro-5-trifluoromethyl benzonitrile,benzonitrile, 2-chloro-5-trifluoromethyl,4-chloro-3-cyanobenzotrifluoride,4-chloro-3-cyanobenzo trifluoride,4-chloro-3-cyanbenzotrifluoride,2-chloro-5-trifluoromethyl benzenecarbonitrile,ncr bg exfff,pubchem4749,acmc-1cq7c,ksc494q7d
IUPAC Name 2-chloro-5-(trifluoromethyl)benzonitrile
InChI Key LCISFYAQKHOWBP-UHFFFAOYSA-N
Molecular Formula C8H3ClF3N
11,067

2-(Trifluoromethyl)benzyl Chloride 98.0+%, TCI America™

CAS: 21742-00-7 Molecular Formula: C8H6ClF3 Molecular Weight (g/mol): 194.581 MDL Number: MFCD00009920 InChI Key: BBXDMCQDLOCXRA-UHFFFAOYSA-N Synonym: 2-trifluoromethyl benzyl chloride,1-chloromethyl-2-trifluoromethyl benzene,2-trifluoromethyl benzylchloride,2-trifluoromethylbenzyl chloride,o-trifluoromethylbenzyl chloride,benzene, 1-chloromethyl-2-trifluoromethyl,alpha'-chloro-alpha,alpha,alpha-trifluoro-o-xylene,g1r bxfff,pubchem4692,acmc-209fnp PubChem CID: 89028 IUPAC Name: 1-(chloromethyl)-2-(trifluoromethyl)benzene SMILES: C1=CC=C(C(=C1)CCl)C(F)(F)F

PubChem CID 89028
CAS 21742-00-7
Molecular Weight (g/mol) 194.581
MDL Number MFCD00009920
SMILES C1=CC=C(C(=C1)CCl)C(F)(F)F
Synonym 2-trifluoromethyl benzyl chloride,1-chloromethyl-2-trifluoromethyl benzene,2-trifluoromethyl benzylchloride,2-trifluoromethylbenzyl chloride,o-trifluoromethylbenzyl chloride,benzene, 1-chloromethyl-2-trifluoromethyl,alpha'-chloro-alpha,alpha,alpha-trifluoro-o-xylene,g1r bxfff,pubchem4692,acmc-209fnp
IUPAC Name 1-(chloromethyl)-2-(trifluoromethyl)benzene
InChI Key BBXDMCQDLOCXRA-UHFFFAOYSA-N
Molecular Formula C8H6ClF3
11,068

Methyl 2-(Trifluoromethyl)benzoate 98.0+%, TCI America™

CAS: 344-96-7 Molecular Formula: C9H7F3O2 Molecular Weight (g/mol): 204.148 MDL Number: MFCD00236050 InChI Key: JLCAMDSWNZBTEE-UHFFFAOYSA-N Synonym: methyl 2-trifluoromethyl benzoate,benzoic acid, trifluoromethyl-, methyl ester,acmc-1ahfp,methyl o-trifluoromethylbenzoate,jlcamdswnzbtee-uhfffaoysa,methyl-2-trifluoromethyl benzoate,2-trifluoromethylbenzoic acid methyl ester,2-trifluoromethyl-benzoic acid methyl ester,2-trifluoromethyl benzoic acid methyl ester,methyl alpha,alpha,alpha-trifluoro-o-toluate PubChem CID: 2775578 IUPAC Name: methyl 2-(trifluoromethyl)benzoate SMILES: COC(=O)C1=CC=CC=C1C(F)(F)F

PubChem CID 2775578
CAS 344-96-7
Molecular Weight (g/mol) 204.148
MDL Number MFCD00236050
SMILES COC(=O)C1=CC=CC=C1C(F)(F)F
Synonym methyl 2-trifluoromethyl benzoate,benzoic acid, trifluoromethyl-, methyl ester,acmc-1ahfp,methyl o-trifluoromethylbenzoate,jlcamdswnzbtee-uhfffaoysa,methyl-2-trifluoromethyl benzoate,2-trifluoromethylbenzoic acid methyl ester,2-trifluoromethyl-benzoic acid methyl ester,2-trifluoromethyl benzoic acid methyl ester,methyl alpha,alpha,alpha-trifluoro-o-toluate
IUPAC Name methyl 2-(trifluoromethyl)benzoate
InChI Key JLCAMDSWNZBTEE-UHFFFAOYSA-N
Molecular Formula C9H7F3O2
11,069

N-Methyl-4-(trifluoromethyl)aniline 98.0+%, TCI America™

CAS: 22864-65-9 Molecular Formula: C8H8F3N Molecular Weight (g/mol): 175.154 MDL Number: MFCD07369717 InChI Key: UTUYWZJPVLDHJJ-UHFFFAOYSA-N PubChem CID: 15099755 IUPAC Name: N-methyl-4-(trifluoromethyl)aniline SMILES: CNC1=CC=C(C=C1)C(F)(F)F

PubChem CID 15099755
CAS 22864-65-9
Molecular Weight (g/mol) 175.154
MDL Number MFCD07369717
SMILES CNC1=CC=C(C=C1)C(F)(F)F
IUPAC Name N-methyl-4-(trifluoromethyl)aniline
InChI Key UTUYWZJPVLDHJJ-UHFFFAOYSA-N
Molecular Formula C8H8F3N
11,070

2-(3-Trifluoromethylanilino)nicotinic Acid 98.0+%, TCI America™

CAS: 4394-00-7 Molecular Formula: C13H9F3N2O2 Molecular Weight (g/mol): 282.22 MDL Number: MFCD00010569 InChI Key: JZFPYUNJRRFVQU-UHFFFAOYSA-N Synonym: niflumic acid,nifluril,landruma,forenol,actol,acido niflumico,nifluminic acid,acide niflumique,acidum niflumicum,acide niflumique inn-french PubChem CID: 4488 ChEBI: CHEBI:34888 IUPAC Name: 2-{[3-(trifluoromethyl)phenyl]amino}pyridine-3-carboxylic acid SMILES: OC(=O)C1=CC=CN=C1NC1=CC=CC(=C1)C(F)(F)F

PubChem CID 4488
CAS 4394-00-7
Molecular Weight (g/mol) 282.22
ChEBI CHEBI:34888
MDL Number MFCD00010569
SMILES OC(=O)C1=CC=CN=C1NC1=CC=CC(=C1)C(F)(F)F
Synonym niflumic acid,nifluril,landruma,forenol,actol,acido niflumico,nifluminic acid,acide niflumique,acidum niflumicum,acide niflumique inn-french
IUPAC Name 2-{[3-(trifluoromethyl)phenyl]amino}pyridine-3-carboxylic acid
InChI Key JZFPYUNJRRFVQU-UHFFFAOYSA-N
Molecular Formula C13H9F3N2O2