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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 (6,366)
Phenol esters (4,814)
Unsubstituted Phenols (1,453)
Fluorenes (1,280)
Thiophenols (762)
Anthracenes (515)
Indanes (488)
Phenanthrenes and derivatives (364)
Tetralins (337)
Triphenyl compounds (278)
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Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (16)
Pentacenequinones (16)
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1-hydroxylamino 2-unsubstituted benzenoids (6)

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4,081 – 4,095 of 159,106 results
4,081
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2-Bromo-1-indanol, 99%

CAS: 5400-80-6 Molecular Formula: C9H9BrO Molecular Weight (g/mol): 213.07 MDL Number: MFCD00003798 InChI Key: RTESDSDXFLYAKZ-UHFFFAOYNA-N Synonym: 2-bromo-1-indanol,2-bromoindan-1-ol,1-hydroxy-2-bromoindan,2-bromo-1-hydroxyindane,2-bromo-1-hydroxyhydrindene,1h-inden-1-ol, 2-bromo-2,3-dihydro,trans-2-bromo-1-indanol,bromoindanol,acmc-20ajgx,pubchem3783 PubChem CID: 95444 IUPAC Name: 2-bromo-2,3-dihydro-1H-inden-1-ol SMILES: OC1C(Br)CC2=CC=CC=C12

PubChem CID 95444
CAS 5400-80-6
Molecular Weight (g/mol) 213.07
MDL Number MFCD00003798
SMILES OC1C(Br)CC2=CC=CC=C12
Synonym 2-bromo-1-indanol,2-bromoindan-1-ol,1-hydroxy-2-bromoindan,2-bromo-1-hydroxyindane,2-bromo-1-hydroxyhydrindene,1h-inden-1-ol, 2-bromo-2,3-dihydro,trans-2-bromo-1-indanol,bromoindanol,acmc-20ajgx,pubchem3783
IUPAC Name 2-bromo-2,3-dihydro-1H-inden-1-ol
InChI Key RTESDSDXFLYAKZ-UHFFFAOYNA-N
Molecular Formula C9H9BrO
4,082

7-Methyl-2,3-dihydro-1H-inden-4-yl acetate, 97%, Thermo Scientific™

CAS: 175136-12-6 Molecular Formula: C12H14O2 Molecular Weight (g/mol): 190.24 MDL Number: MFCD00173682 InChI Key: MABWFAYFFNHAOF-UHFFFAOYSA-N Synonym: 4-acetoxy-7-methylindane,acmc-1c5pj,7-methylindan-4-yl acetate,7-methyl-2,3-dihydro-1h-inden-4-yl acetate,1h-inden-4-ol,2,3-dihydro-7-methyl-,4-acetate,1h-inden-4-ol,2,3-dihydro-7-methyl-, 4-acetate PubChem CID: 2775024 IUPAC Name: (7-methyl-2,3-dihydro-1H-inden-4-yl) acetate SMILES: CC(=O)OC1=CC=C(C)C2=C1CCC2

PubChem CID 2775024
CAS 175136-12-6
Molecular Weight (g/mol) 190.24
MDL Number MFCD00173682
SMILES CC(=O)OC1=CC=C(C)C2=C1CCC2
Synonym 4-acetoxy-7-methylindane,acmc-1c5pj,7-methylindan-4-yl acetate,7-methyl-2,3-dihydro-1h-inden-4-yl acetate,1h-inden-4-ol,2,3-dihydro-7-methyl-,4-acetate,1h-inden-4-ol,2,3-dihydro-7-methyl-, 4-acetate
IUPAC Name (7-methyl-2,3-dihydro-1H-inden-4-yl) acetate
InChI Key MABWFAYFFNHAOF-UHFFFAOYSA-N
Molecular Formula C12H14O2
4,083
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2-Indanylboronic acid pinacol ester, 95%

CAS: 608534-44-7 Molecular Formula: C15H21BO2 Molecular Weight (g/mol): 244.14 MDL Number: MFCD03788726 InChI Key: YRTKSYXHFWUPAZ-UHFFFAOYSA-N Synonym: 2-indanylboronic acid pinacol ester,2-2,3-dihydro-1h-inden-2-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-indanylboronicacidpinacolester,2-indan-2-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane PubChem CID: 24208876 IUPAC Name: 2-(2,3-dihydro-1H-inden-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: CC1(C)OB(OC1(C)C)C1CC2=CC=CC=C2C1

PubChem CID 24208876
CAS 608534-44-7
Molecular Weight (g/mol) 244.14
MDL Number MFCD03788726
SMILES CC1(C)OB(OC1(C)C)C1CC2=CC=CC=C2C1
Synonym 2-indanylboronic acid pinacol ester,2-2,3-dihydro-1h-inden-2-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-indanylboronicacidpinacolester,2-indan-2-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
IUPAC Name 2-(2,3-dihydro-1H-inden-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI Key YRTKSYXHFWUPAZ-UHFFFAOYSA-N
Molecular Formula C15H21BO2
4,084
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2-Aminoindan hydrochloride, 98%

CAS: 2338-18-3 Molecular Formula: C9H11ClN Molecular Weight (g/mol): 168.64 MDL Number: MFCD00012549 InChI Key: DLYRFJDJKGGVKT-UHFFFAOYSA-N Synonym: 2-aminoindan hydrochloride,2-aminoindane hydrochloride,2,3-dihydro-1h-inden-2-amine hydrochloride,2-aminoindane hcl,2-indanamine hydrochloride,2-indanamine, hydrochloride,2-indanylamine hydrochloride,su 8629 hydrochloride,indan-2-ylammonium chloride,indan-2-ylamine hydrochloride PubChem CID: 122764 IUPAC Name: 2,3-dihydro-1H-inden-2-amine;hydrochloride SMILES: [Cl].NC1CC2=CC=CC=C2C1

PubChem CID 122764
CAS 2338-18-3
Molecular Weight (g/mol) 168.64
MDL Number MFCD00012549
SMILES [Cl].NC1CC2=CC=CC=C2C1
Synonym 2-aminoindan hydrochloride,2-aminoindane hydrochloride,2,3-dihydro-1h-inden-2-amine hydrochloride,2-aminoindane hcl,2-indanamine hydrochloride,2-indanamine, hydrochloride,2-indanylamine hydrochloride,su 8629 hydrochloride,indan-2-ylammonium chloride,indan-2-ylamine hydrochloride
IUPAC Name 2,3-dihydro-1H-inden-2-amine;hydrochloride
InChI Key DLYRFJDJKGGVKT-UHFFFAOYSA-N
Molecular Formula C9H11ClN
4,085
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Indan-2-carboxylic acid, 98%

CAS: 25177-85-9 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00085095 InChI Key: XUDCMQBOWOLYCF-UHFFFAOYSA-N Synonym: 2-indancarboxylic acid,indane-2-carboxylic acid,indan-2-carboxylic acid,2-indanecarboxylic acid,1h-indene-2-carboxylic acid, 2,3-dihydro,chembl81558,2-carboxyindane,2-carboxy-indan,2-carboxy-indane,2-indancarboxylicacid PubChem CID: 575777 IUPAC Name: 2,3-dihydro-1H-indene-2-carboxylic acid SMILES: OC(=O)C1CC2=CC=CC=C2C1

PubChem CID 575777
CAS 25177-85-9
Molecular Weight (g/mol) 162.19
MDL Number MFCD00085095
SMILES OC(=O)C1CC2=CC=CC=C2C1
Synonym 2-indancarboxylic acid,indane-2-carboxylic acid,indan-2-carboxylic acid,2-indanecarboxylic acid,1h-indene-2-carboxylic acid, 2,3-dihydro,chembl81558,2-carboxyindane,2-carboxy-indan,2-carboxy-indane,2-indancarboxylicacid
IUPAC Name 2,3-dihydro-1H-indene-2-carboxylic acid
InChI Key XUDCMQBOWOLYCF-UHFFFAOYSA-N
Molecular Formula C10H10O2
4,086

Hematoxylin hydrate, 80% (dry wt.), water <8%

CAS: 517-28-2 Molecular Formula: C16H14O6 Molecular Weight (g/mol): 302.28 MDL Number: MFCD00078111 InChI Key: WZUVPPKBWHMQCE-WKTCHCBJNA-N Synonym: hematoxylin,hydroxybrasilin PubChem CID: 45029742 IUPAC Name: (6aR)-7,11b-dihydro-6H-indeno[2,1-c]chromene-3,4,6a,9,10-pentol SMILES: [H][C@]12C3=C(C[C@@]1(O)COC1=C2C=CC(O)=C1O)C=C(O)C(O)=C3

PubChem CID 45029742
CAS 517-28-2
Molecular Weight (g/mol) 302.28
MDL Number MFCD00078111
SMILES [H][C@]12C3=C(C[C@@]1(O)COC1=C2C=CC(O)=C1O)C=C(O)C(O)=C3
Synonym hematoxylin,hydroxybrasilin
IUPAC Name (6aR)-7,11b-dihydro-6H-indeno[2,1-c]chromene-3,4,6a,9,10-pentol
InChI Key WZUVPPKBWHMQCE-WKTCHCBJNA-N
Molecular Formula C16H14O6
4,087
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(1S,2R)-(-)-cis-1-Amino-2-indanol, 99%

CAS: 126456-43-7 Molecular Formula: C9H12NO Molecular Weight (g/mol): 150.20 MDL Number: MFCD00216655 InChI Key: LOPKSXMQWBYUOI-BDAKNGLRSA-O PubChem CID: 9866743 SMILES: [NH3+][C@@H]1[C@H](O)CC2=CC=CC=C12

PubChem CID 9866743
CAS 126456-43-7
Molecular Weight (g/mol) 150.20
MDL Number MFCD00216655
SMILES [NH3+][C@@H]1[C@H](O)CC2=CC=CC=C12
InChI Key LOPKSXMQWBYUOI-BDAKNGLRSA-O
Molecular Formula C9H12NO
4,088
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Methyl 3-chloro-5-iodobenzoate, 98%, Thermo Scientific Chemicals

CAS: 289039-85-6 Molecular Formula: C8H6ClIO2 Molecular Weight (g/mol): 296.488 MDL Number: MFCD00673018 InChI Key: ZDSIXLJPASGHDW-UHFFFAOYSA-N Synonym: acmc-20akhf,methyl 5-chloro-3-iodobenzoate,3-chloro-5-iodo-benzoic acid methyl ester,3-chloro-5-iodobenzoic acid methyl ester PubChem CID: 24721134 IUPAC Name: methyl 3-chloro-5-iodobenzoate SMILES: COC(=O)C1=CC(=CC(=C1)I)Cl

PubChem CID 24721134
CAS 289039-85-6
Molecular Weight (g/mol) 296.488
MDL Number MFCD00673018
SMILES COC(=O)C1=CC(=CC(=C1)I)Cl
Synonym acmc-20akhf,methyl 5-chloro-3-iodobenzoate,3-chloro-5-iodo-benzoic acid methyl ester,3-chloro-5-iodobenzoic acid methyl ester
IUPAC Name methyl 3-chloro-5-iodobenzoate
InChI Key ZDSIXLJPASGHDW-UHFFFAOYSA-N
Molecular Formula C8H6ClIO2
4,089
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3,4-Difluorobenzoyl chloride, 98%

CAS: 76903-88-3 Molecular Formula: C7H3ClF2O Molecular Weight (g/mol): 176.55 MDL Number: MFCD00009930 InChI Key: RPQWXGVZELKOEU-UHFFFAOYSA-N Synonym: 3,4-difluorobenzoylchloride,benzoyl chloride, 3,4-difluoro,3,4-difluoro benzoyl chloride,pubchem14796,acmc-209p6r,3,4 difluorobenzoylchloride,3,4-diflorobenzoyl chloride,3,4-difluorobezoyl chloride,3,4-diflourobenzoyl chloride,ksc494e2f PubChem CID: 2724519 IUPAC Name: 3,4-difluorobenzoyl chloride SMILES: FC1=CC=C(C=C1F)C(Cl)=O

PubChem CID 2724519
CAS 76903-88-3
Molecular Weight (g/mol) 176.55
MDL Number MFCD00009930
SMILES FC1=CC=C(C=C1F)C(Cl)=O
Synonym 3,4-difluorobenzoylchloride,benzoyl chloride, 3,4-difluoro,3,4-difluoro benzoyl chloride,pubchem14796,acmc-209p6r,3,4 difluorobenzoylchloride,3,4-diflorobenzoyl chloride,3,4-difluorobezoyl chloride,3,4-diflourobenzoyl chloride,ksc494e2f
IUPAC Name 3,4-difluorobenzoyl chloride
InChI Key RPQWXGVZELKOEU-UHFFFAOYSA-N
Molecular Formula C7H3ClF2O
4,090
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4-Bromo-2,3,5,6-tetrafluorobenzoic acid, 97+%

CAS: 4707-24-8 Molecular Formula: C7HBrF4O2 Molecular Weight (g/mol): 272.981 MDL Number: MFCD00075244 InChI Key: MTZLICDXLGQWJV-UHFFFAOYSA-N Synonym: 4-bromo-2,3,5,6-tetrafluoro-benzoic acid,acmc-1arsf,4-bromotetrafluorobenzoic acid,4-bromotetrafluorobenzene carboxylic acid,benzoicacid, 4-bromo-2,3,5,6-tetrafluoro,benzoic acid, 4-bromo-2,3,5,6-tetrafluoro,4-bromo-2,3,5,6-tetrafluorobenzoic acid,4-bromanyl-2,3,5,6-tetrakis fluoranyl benzoic acid PubChem CID: 298173 IUPAC Name: 4-bromo-2,3,5,6-tetrafluorobenzoic acid SMILES: C1(=C(C(=C(C(=C1F)F)Br)F)F)C(=O)O

PubChem CID 298173
CAS 4707-24-8
Molecular Weight (g/mol) 272.981
MDL Number MFCD00075244
SMILES C1(=C(C(=C(C(=C1F)F)Br)F)F)C(=O)O
Synonym 4-bromo-2,3,5,6-tetrafluoro-benzoic acid,acmc-1arsf,4-bromotetrafluorobenzoic acid,4-bromotetrafluorobenzene carboxylic acid,benzoicacid, 4-bromo-2,3,5,6-tetrafluoro,benzoic acid, 4-bromo-2,3,5,6-tetrafluoro,4-bromo-2,3,5,6-tetrafluorobenzoic acid,4-bromanyl-2,3,5,6-tetrakis fluoranyl benzoic acid
IUPAC Name 4-bromo-2,3,5,6-tetrafluorobenzoic acid
InChI Key MTZLICDXLGQWJV-UHFFFAOYSA-N
Molecular Formula C7HBrF4O2
4,091
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Methyl 5-bromo-2-methylbenzoate, 98%

CAS: 79669-50-4 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD09839555 InChI Key: FDCYLMYCHALQJR-UHFFFAOYSA-N Synonym: methyl 5-bromo-2-methyl-benzoate,methyl 5-bromo-o-toluate,methyl5-bromo-2-methylbenzoate,5-bromo-2-methyl-benzoic acid methyl ester,benzoic acid, 5-bromo-2-methyl-, methyl ester,5-bromo-2-methylbenzoic acid methyl ester,5-bromo-2-methylbenzoicacid,methyl 4-bromo-toluate,pubchem10936,acmc-1bhme PubChem CID: 316201 IUPAC Name: methyl 5-bromo-2-methylbenzoate SMILES: CC1=C(C=C(C=C1)Br)C(=O)OC

PubChem CID 316201
CAS 79669-50-4
Molecular Weight (g/mol) 229.073
MDL Number MFCD09839555
SMILES CC1=C(C=C(C=C1)Br)C(=O)OC
Synonym methyl 5-bromo-2-methyl-benzoate,methyl 5-bromo-o-toluate,methyl5-bromo-2-methylbenzoate,5-bromo-2-methyl-benzoic acid methyl ester,benzoic acid, 5-bromo-2-methyl-, methyl ester,5-bromo-2-methylbenzoic acid methyl ester,5-bromo-2-methylbenzoicacid,methyl 4-bromo-toluate,pubchem10936,acmc-1bhme
IUPAC Name methyl 5-bromo-2-methylbenzoate
InChI Key FDCYLMYCHALQJR-UHFFFAOYSA-N
Molecular Formula C9H9BrO2
4,092
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4-Bromo-3-methylbenzoic acid, 97%

CAS: 7697-28-1 Molecular Formula: C8H6BrO2 Molecular Weight (g/mol): 214.04 MDL Number: MFCD00039526 InChI Key: KWVXDZLVCISXIB-UHFFFAOYSA-M Synonym: 4-bromo-m-toluic acid,4-bromo-3-methyl-benzoic acid,4-bromo-3-methylbenzoicacid,3-methyl-4-bromobenzoic acid,4-bromo-3-methyl benzoic acid,benzoic acid, 4-bromo-3-methyl,pubchem3807,4bromo-3-methylbenzoic acid,4-bromo-5-methylbenzoic acid,ksc379g0b PubChem CID: 82131 IUPAC Name: 4-bromo-3-methylbenzoic acid SMILES: CC1=CC(=CC=C1Br)C([O-])=O

PubChem CID 82131
CAS 7697-28-1
Molecular Weight (g/mol) 214.04
MDL Number MFCD00039526
SMILES CC1=CC(=CC=C1Br)C([O-])=O
Synonym 4-bromo-m-toluic acid,4-bromo-3-methyl-benzoic acid,4-bromo-3-methylbenzoicacid,3-methyl-4-bromobenzoic acid,4-bromo-3-methyl benzoic acid,benzoic acid, 4-bromo-3-methyl,pubchem3807,4bromo-3-methylbenzoic acid,4-bromo-5-methylbenzoic acid,ksc379g0b
IUPAC Name 4-bromo-3-methylbenzoic acid
InChI Key KWVXDZLVCISXIB-UHFFFAOYSA-M
Molecular Formula C8H6BrO2
4,093

Diphenyl Iodonium-2-carboxylate, MP Biomedicals

CAS: 109545-72-4 Molecular Formula: C13H9IO2 Molecular Weight (g/mol): 324.117 InChI Key: LUGVQQXOGHCZNN-UHFFFAOYSA-N Synonym: diphenyliodonium-2-carboxylate,iodonium, 2-carboxyphenyl phenyl-, inner salt,2-carboxylatophenyl phenyliodonium,2-carboxyphenyl phenyliodonium hydroxide inner salt,iodonium, 2-carboxyphenyl phenyl-,hydroxide,innersalt,diphenyliodonium-2-carboxylate monohydrate, 98+%,2-carboxylatophenyl phenyl iodanium,iodonium, hydroxide, inner salt,iodonium, 2-carboxyphenyl phenyl-, hydroxide, inner salt,iodonium, o-carboxyphenyl phenyl-, hydroxide, inner salt PubChem CID: 73883 IUPAC Name: 2-phenyliodoniobenzoate SMILES: C1=CC=C(C=C1)[I+]C2=CC=CC=C2C(=O)[O-]

PubChem CID 73883
CAS 109545-72-4
Molecular Weight (g/mol) 324.117
SMILES C1=CC=C(C=C1)[I+]C2=CC=CC=C2C(=O)[O-]
Synonym diphenyliodonium-2-carboxylate,iodonium, 2-carboxyphenyl phenyl-, inner salt,2-carboxylatophenyl phenyliodonium,2-carboxyphenyl phenyliodonium hydroxide inner salt,iodonium, 2-carboxyphenyl phenyl-,hydroxide,innersalt,diphenyliodonium-2-carboxylate monohydrate, 98+%,2-carboxylatophenyl phenyl iodanium,iodonium, hydroxide, inner salt,iodonium, 2-carboxyphenyl phenyl-, hydroxide, inner salt,iodonium, o-carboxyphenyl phenyl-, hydroxide, inner salt
IUPAC Name 2-phenyliodoniobenzoate
InChI Key LUGVQQXOGHCZNN-UHFFFAOYSA-N
Molecular Formula C13H9IO2
4,094
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Methyl 4-bromobenzoate, 99%

CAS: 619-42-1 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.05 MDL Number: MFCD00013531 InChI Key: CZNGTXVOZOWWKM-UHFFFAOYSA-N Synonym: benzoic acid, 4-bromo-, methyl ester,methyl p-bromobenzoate,4-bromobenzoic acid methyl ester,p-bromobenzoic acid, methyl ester,unii-ub1ysj5xar,ub1ysj5xar,benzoic acid, p-bromo-, methyl ester,pubchem3962,methyl-4-bromobenzoate,methyl p-bromo benzoate PubChem CID: 12081 IUPAC Name: methyl 4-bromobenzoate SMILES: COC(=O)C1=CC=C(C=C1)Br

PubChem CID 12081
CAS 619-42-1
Molecular Weight (g/mol) 215.05
MDL Number MFCD00013531
SMILES COC(=O)C1=CC=C(C=C1)Br
Synonym benzoic acid, 4-bromo-, methyl ester,methyl p-bromobenzoate,4-bromobenzoic acid methyl ester,p-bromobenzoic acid, methyl ester,unii-ub1ysj5xar,ub1ysj5xar,benzoic acid, p-bromo-, methyl ester,pubchem3962,methyl-4-bromobenzoate,methyl p-bromo benzoate
IUPAC Name methyl 4-bromobenzoate
InChI Key CZNGTXVOZOWWKM-UHFFFAOYSA-N
Molecular Formula C8H7BrO2
4,095
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6-Methylsalicylic acid, 98%

CAS: 567-61-3 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD01194284 InChI Key: HCJMNOSIAGSZBM-UHFFFAOYSA-N Synonym: 6-methylsalicylic acid,6-hydroxy-o-toluic acid,2,6-cresotic acid,6-msa,benzoic acid, 2-hydroxy-6-methyl,6-ms,methylsalicylic acid,2-hydroxy-6-methylbenzoicacid,unii-l5352fe23y,2-carboxy-3-methylphenol PubChem CID: 11279 ChEBI: CHEBI:17637 IUPAC Name: 2-hydroxy-6-methylbenzoic acid SMILES: CC1=CC=CC(O)=C1C(O)=O

PubChem CID 11279
CAS 567-61-3
Molecular Weight (g/mol) 152.15
ChEBI CHEBI:17637
MDL Number MFCD01194284
SMILES CC1=CC=CC(O)=C1C(O)=O
Synonym 6-methylsalicylic acid,6-hydroxy-o-toluic acid,2,6-cresotic acid,6-msa,benzoic acid, 2-hydroxy-6-methyl,6-ms,methylsalicylic acid,2-hydroxy-6-methylbenzoicacid,unii-l5352fe23y,2-carboxy-3-methylphenol
IUPAC Name 2-hydroxy-6-methylbenzoic acid
InChI Key HCJMNOSIAGSZBM-UHFFFAOYSA-N
Molecular Formula C8H8O3