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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 (64,928)
Phenols (11,906)
Naphthalenes (4,958)
Fluorenes (1,242)
Unsubstituted Phenols (1,173)
Thiophenols (610)
Phenol esters (426)
Anthracenes (400)
Tetralins (329)
Phenanthrenes and derivatives (300)
Triphenyl compounds (290)
Indanes (288)
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Dibenzocycloheptenes (65)
Ellagic acids and derivatives (33)
Naphthacenes (31)
Acenaphthylenes (16)
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1-hydroxylamino 2-unsubstituted benzenoids (5)

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8,956 – 8,970 of 73,813 results
8,956

Methyl 5-Chloro-2-nitrobenzoate 98.0+%, TCI America™
SDP

CAS: 51282-49-6 Molecular Formula: C8H6ClNO4 Molecular Weight (g/mol): 215.589 MDL Number: MFCD00272139 InChI Key: JGBJHRKCUKTQOE-UHFFFAOYSA-N Synonym: 5-chloro-2-nitrobenzoic acid methyl ester,benzoic acid, 5-chloro-2-nitro-, methyl ester,unii-1t5d4k1v51,methyl 5-chloro-2-nitro-benzoate,pubchem3712,acmc-209ksr,dsstox_cid_24948,dsstox_rid_80608,dsstox_gsid_44948,ksc495i7r PubChem CID: 171018 IUPAC Name: methyl 5-chloro-2-nitrobenzoate SMILES: COC(=O)C1=C(C=CC(=C1)Cl)[N+](=O)[O-]

PubChem CID 171018
CAS 51282-49-6
Molecular Weight (g/mol) 215.589
MDL Number MFCD00272139
SMILES COC(=O)C1=C(C=CC(=C1)Cl)[N+](=O)[O-]
Synonym 5-chloro-2-nitrobenzoic acid methyl ester,benzoic acid, 5-chloro-2-nitro-, methyl ester,unii-1t5d4k1v51,methyl 5-chloro-2-nitro-benzoate,pubchem3712,acmc-209ksr,dsstox_cid_24948,dsstox_rid_80608,dsstox_gsid_44948,ksc495i7r
IUPAC Name methyl 5-chloro-2-nitrobenzoate
InChI Key JGBJHRKCUKTQOE-UHFFFAOYSA-N
Molecular Formula C8H6ClNO4
8,957

3-Bromo-5-(trifluoromethyl)benzoic Acid 98.0+%, TCI America™
SDP

CAS: 328-67-6 Molecular Formula: C8H4BrF3O2 Molecular Weight (g/mol): 269.02 MDL Number: MFCD03412186 InChI Key: AMZBKZQMAZWIJM-UHFFFAOYSA-N Synonym: 3-bromo-5-trifluoromethyl benzoic acid,3-bromo-5-trifluoromethyl-benzoic acid,5-bromo-3-trifluoromethyl benzoic acid,3-bromo-5-trifluoromethylbenzoicacid,benzoic acid, 3-bromo-5-trifluoromethyl,pubchem4737,3-bromo-5-trifluoromethyl benzoicacid,acmc-1clgk,ksc222e0t PubChem CID: 11086788 IUPAC Name: 3-bromo-5-(trifluoromethyl)benzoic acid SMILES: OC(=O)C1=CC(=CC(Br)=C1)C(F)(F)F

PubChem CID 11086788
CAS 328-67-6
Molecular Weight (g/mol) 269.02
MDL Number MFCD03412186
SMILES OC(=O)C1=CC(=CC(Br)=C1)C(F)(F)F
Synonym 3-bromo-5-trifluoromethyl benzoic acid,3-bromo-5-trifluoromethyl-benzoic acid,5-bromo-3-trifluoromethyl benzoic acid,3-bromo-5-trifluoromethylbenzoicacid,benzoic acid, 3-bromo-5-trifluoromethyl,pubchem4737,3-bromo-5-trifluoromethyl benzoicacid,acmc-1clgk,ksc222e0t
IUPAC Name 3-bromo-5-(trifluoromethyl)benzoic acid
InChI Key AMZBKZQMAZWIJM-UHFFFAOYSA-N
Molecular Formula C8H4BrF3O2
8,958

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

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

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
8,959

4'-Acetoxyacetanilide 99.0+%, TCI America™
SDP

CAS: 2623-33-8 Molecular Formula: C10H11NO3 Molecular Weight (g/mol): 193.20 MDL Number: MFCD00059205 InChI Key: UJAOSPFULOFZRR-UHFFFAOYSA-N Synonym: N,O-Diacetyl-4-aminophenol PubChem CID: 17499 IUPAC Name: 4-acetamidophenyl acetate SMILES: CC(=O)NC1=CC=C(OC(C)=O)C=C1

PubChem CID 17499
CAS 2623-33-8
Molecular Weight (g/mol) 193.20
MDL Number MFCD00059205
SMILES CC(=O)NC1=CC=C(OC(C)=O)C=C1
Synonym N,O-Diacetyl-4-aminophenol
IUPAC Name 4-acetamidophenyl acetate
InChI Key UJAOSPFULOFZRR-UHFFFAOYSA-N
Molecular Formula C10H11NO3
8,960

3,3-Diphenylpropyl Bromide 98.0+%, TCI America™
SDP

CAS: 20017-68-9 Molecular Formula: C15H15Br Molecular Weight (g/mol): 275.19 MDL Number: MFCD00044829 InChI Key: SLHSRCBFPHCSGL-UHFFFAOYSA-N Synonym: 1-bromo-3,3-diphenylpropane,3,3-diphenylpropyl bromide,3-bromo-1,1-diphenylpropane,3-bromopropane-1,1-diyl dibenzene,3-bromo-1-phenylpropyl benzene,3,3-diphenylpropylbromide,1,1'-3-bromopropylidene bisbenzene,benzene, 1,1'-3-bromopropylidene bis,acmc-1cjoi,3,3-diphenyl-1-propylbromide PubChem CID: 88333 IUPAC Name: (3-bromo-1-phenylpropyl)benzene SMILES: BrCCC(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 88333
CAS 20017-68-9
Molecular Weight (g/mol) 275.19
MDL Number MFCD00044829
SMILES BrCCC(C1=CC=CC=C1)C1=CC=CC=C1
Synonym 1-bromo-3,3-diphenylpropane,3,3-diphenylpropyl bromide,3-bromo-1,1-diphenylpropane,3-bromopropane-1,1-diyl dibenzene,3-bromo-1-phenylpropyl benzene,3,3-diphenylpropylbromide,1,1'-3-bromopropylidene bisbenzene,benzene, 1,1'-3-bromopropylidene bis,acmc-1cjoi,3,3-diphenyl-1-propylbromide
IUPAC Name (3-bromo-1-phenylpropyl)benzene
InChI Key SLHSRCBFPHCSGL-UHFFFAOYSA-N
Molecular Formula C15H15Br
8,961

Lumefantrine 98.0+%, TCI America™
SDP

CAS: 82186-77-4 Molecular Formula: C30H32Cl3NO Molecular Weight (g/mol): 528.94 MDL Number: MFCD05662268 InChI Key: DYLGFOYVTXJFJP-MYYYXRDXNA-N Synonym: Benflumetol, (9Z)-2,7-Dichloro-9-[(4-chlorophenyl)methylene]-alpha-[(dibutylamino)methyl]-9H-fluoren-4-methanol PubChem CID: 6437380 ChEBI: CHEBI:156095 IUPAC Name: 2-(dibutylamino)-1-[(9Z)-2,7-dichloro-9-[(4-chlorophenyl)methylidene]-9H-fluoren-4-yl]ethan-1-ol SMILES: CCCCN(CCCC)CC(O)C1=CC(Cl)=CC2=C1C1=CC=C(Cl)C=C1\C2=C\C1=CC=C(Cl)C=C1

PubChem CID 6437380
CAS 82186-77-4
Molecular Weight (g/mol) 528.94
ChEBI CHEBI:156095
MDL Number MFCD05662268
SMILES CCCCN(CCCC)CC(O)C1=CC(Cl)=CC2=C1C1=CC=C(Cl)C=C1\C2=C\C1=CC=C(Cl)C=C1
Synonym Benflumetol, (9Z)-2,7-Dichloro-9-[(4-chlorophenyl)methylene]-alpha-[(dibutylamino)methyl]-9H-fluoren-4-methanol
IUPAC Name 2-(dibutylamino)-1-[(9Z)-2,7-dichloro-9-[(4-chlorophenyl)methylidene]-9H-fluoren-4-yl]ethan-1-ol
InChI Key DYLGFOYVTXJFJP-MYYYXRDXNA-N
Molecular Formula C30H32Cl3NO
8,962

4-Hydroxy-3,5-dimethylbenzonitrile 95.0+%, TCI America™
SDP

CAS: 4198-90-7 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 MDL Number: MFCD00221716 InChI Key: WFYGXOWFEIOHCZ-UHFFFAOYSA-N Synonym: 3,5-dimethyl-4-hydroxybenzonitrile,4-cyano-2,6-dimethylphenol,2,6-dimethyl-4-cyanophenol,4-hydroxy-3,5-dimethyl-benzonitrile,3,5-dimethyl-4-hydroxy benzonitrile,benzonitrile, 3,5-dimethyl-4-hydroxy,4-hydroxy-3,5-dimethylbenzenecarbonitrile,benzonitrile, 4-hydroxy-3,5-dimethyl,pubchem11065,acmc-209jmm PubChem CID: 20176 IUPAC Name: 4-hydroxy-3,5-dimethylbenzonitrile SMILES: CC1=CC(=CC(=C1O)C)C#N

PubChem CID 20176
CAS 4198-90-7
Molecular Weight (g/mol) 147.177
MDL Number MFCD00221716
SMILES CC1=CC(=CC(=C1O)C)C#N
Synonym 3,5-dimethyl-4-hydroxybenzonitrile,4-cyano-2,6-dimethylphenol,2,6-dimethyl-4-cyanophenol,4-hydroxy-3,5-dimethyl-benzonitrile,3,5-dimethyl-4-hydroxy benzonitrile,benzonitrile, 3,5-dimethyl-4-hydroxy,4-hydroxy-3,5-dimethylbenzenecarbonitrile,benzonitrile, 4-hydroxy-3,5-dimethyl,pubchem11065,acmc-209jmm
IUPAC Name 4-hydroxy-3,5-dimethylbenzonitrile
InChI Key WFYGXOWFEIOHCZ-UHFFFAOYSA-N
Molecular Formula C9H9NO
8,963

4-Iodophenylboronic Acid (contains varying amounts of Anhydride), TCI America™
SDP

CAS: 5122-99-6 Molecular Formula: C6H6BIO2 Molecular Weight (g/mol): 247.83 MDL Number: MFCD01319014 InChI Key: PELJYVULHLKXFF-UHFFFAOYSA-N Synonym: 4-iodophenyl boronic acid,4-iodobenzeneboronic acid,p-iodophenylboronic acid,4-iodophenylboronicacid,p-iodobenzeneboronic acid,p-iodophenyl boronic acid,boronic acid, 4-iodophenyl,4-boronoiodobenzene,pubchem6160,pubchem11574 PubChem CID: 151254 IUPAC Name: (4-iodophenyl)boronic acid SMILES: OB(O)C1=CC=C(I)C=C1

PubChem CID 151254
CAS 5122-99-6
Molecular Weight (g/mol) 247.83
MDL Number MFCD01319014
SMILES OB(O)C1=CC=C(I)C=C1
Synonym 4-iodophenyl boronic acid,4-iodobenzeneboronic acid,p-iodophenylboronic acid,4-iodophenylboronicacid,p-iodobenzeneboronic acid,p-iodophenyl boronic acid,boronic acid, 4-iodophenyl,4-boronoiodobenzene,pubchem6160,pubchem11574
IUPAC Name (4-iodophenyl)boronic acid
InChI Key PELJYVULHLKXFF-UHFFFAOYSA-N
Molecular Formula C6H6BIO2
8,964

4,4'-Diiodo-3,3'-dimethylbiphenyl 98.0+%, TCI America™
SDP

CAS: 7583-27-9 Molecular Formula: C14H12I2 Molecular Weight (g/mol): 434.059 MDL Number: MFCD04038414 InChI Key: ISWXEMYZGWXIIZ-UHFFFAOYSA-N PubChem CID: 22323609 IUPAC Name: 1-iodo-4-(4-iodo-3-methylphenyl)-2-methylbenzene SMILES: CC1=C(C=CC(=C1)C2=CC(=C(C=C2)I)C)I

PubChem CID 22323609
CAS 7583-27-9
Molecular Weight (g/mol) 434.059
MDL Number MFCD04038414
SMILES CC1=C(C=CC(=C1)C2=CC(=C(C=C2)I)C)I
IUPAC Name 1-iodo-4-(4-iodo-3-methylphenyl)-2-methylbenzene
InChI Key ISWXEMYZGWXIIZ-UHFFFAOYSA-N
Molecular Formula C14H12I2
8,965

Picene (purified by sublimation) (>99.9%) 99.9+%, TCI America™
SDP

CAS: 213-46-7 Molecular Formula: C22H14 Molecular Weight (g/mol): 278.354 MDL Number: MFCD00215857 InChI Key: GBROPGWFBFCKAG-UHFFFAOYSA-N Synonym: 3,4-benzchrysene,pycene,benzo a chrysene,1,2:7,8-dibenzophenanthrene,beta,beta-binaphthyleneethene,dibenzo a,i phenanthrene,1,2,7,8-dibenzphenanthrene,unii-f70r8zbr7t,f70r8zbr7t PubChem CID: 9162 ChEBI: CHEBI:33090 IUPAC Name: picene SMILES: C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CC5=CC=CC=C54

PubChem CID 9162
CAS 213-46-7
Molecular Weight (g/mol) 278.354
ChEBI CHEBI:33090
MDL Number MFCD00215857
SMILES C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C=CC5=CC=CC=C54
Synonym 3,4-benzchrysene,pycene,benzo a chrysene,1,2:7,8-dibenzophenanthrene,beta,beta-binaphthyleneethene,dibenzo a,i phenanthrene,1,2,7,8-dibenzphenanthrene,unii-f70r8zbr7t,f70r8zbr7t
IUPAC Name picene
InChI Key GBROPGWFBFCKAG-UHFFFAOYSA-N
Molecular Formula C22H14
8,966

3-(4-Hydroxy-3-methoxyphenyl)-1-propanol 98.0+%, TCI America™
SDP

CAS: 2305-13-7 Molecular Formula: C10H14O3 Molecular Weight (g/mol): 182.22 MDL Number: MFCD00016571 InChI Key: MWOMNLDJNQWJMK-UHFFFAOYSA-N Synonym: Dihydroconiferyl Alcohol PubChem CID: 16822 ChEBI: CHEBI:4559 IUPAC Name: 4-(3-hydroxypropyl)-2-methoxyphenol SMILES: COC1=CC(CCCO)=CC=C1O

PubChem CID 16822
CAS 2305-13-7
Molecular Weight (g/mol) 182.22
ChEBI CHEBI:4559
MDL Number MFCD00016571
SMILES COC1=CC(CCCO)=CC=C1O
Synonym Dihydroconiferyl Alcohol
IUPAC Name 4-(3-hydroxypropyl)-2-methoxyphenol
InChI Key MWOMNLDJNQWJMK-UHFFFAOYSA-N
Molecular Formula C10H14O3
8,967

Tetrakis(triphenylacetato)dirhodium(II) Dichloromethane Adduct, TCI America™
SDP

CAS: 142214-04-8 Molecular Formula: C60H45O6Rh Molecular Weight (g/mol): 964.92 MDL Number: MFCD00191694 InChI Key: LJIVYHNRWSWCRU-UHFFFAOYSA-K Synonym: Dirhodium(II) Tetrakis(triphenylacetate), Rhodium(II) Bis(triphenylacetate) Dimer, Rh2(TPA)4 PubChem CID: 71464060 IUPAC Name: rhodium(3+) tritriphenylacetate SMILES: [Rh+3].[O-]C(=O)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[O-]C(=O)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[O-]C(=O)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 71464060
CAS 142214-04-8
Molecular Weight (g/mol) 964.92
MDL Number MFCD00191694
SMILES [Rh+3].[O-]C(=O)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[O-]C(=O)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.[O-]C(=O)C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym Dirhodium(II) Tetrakis(triphenylacetate), Rhodium(II) Bis(triphenylacetate) Dimer, Rh2(TPA)4
IUPAC Name rhodium(3+) tritriphenylacetate
InChI Key LJIVYHNRWSWCRU-UHFFFAOYSA-K
Molecular Formula C60H45O6Rh
8,968

2-Acetamidobenzaldehyde 98.0+%, TCI America™
SDP

CAS: 13493-47-5 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.18 MDL Number: MFCD06739581 InChI Key: OWMJAQBUFVTERI-UHFFFAOYSA-N PubChem CID: 326664 IUPAC Name: N-(2-formylphenyl)acetamide SMILES: CC(=O)NC1=CC=CC=C1C=O

PubChem CID 326664
CAS 13493-47-5
Molecular Weight (g/mol) 163.18
MDL Number MFCD06739581
SMILES CC(=O)NC1=CC=CC=C1C=O
IUPAC Name N-(2-formylphenyl)acetamide
InChI Key OWMJAQBUFVTERI-UHFFFAOYSA-N
Molecular Formula C9H9NO2
8,969

Tetraphenylphosphonium Bromide 98.0+%, TCI America™
SDP

CAS: 2751-90-8 Molecular Formula: C24H20BrP Molecular Weight (g/mol): 419.30 MDL Number: MFCD00011915 InChI Key: BRKFQVAOMSWFDU-UHFFFAOYSA-M Synonym: tetraphenylphosphonium bromide,phosphonium, tetraphenyl-, bromide,tetraphenylphosphoniumbromide,tetraphenylphosponium bromide,tetraphenylphosphanium bromide,phosphonium, tetraphenyl-, bromide 1:1,ph4pbr,bromotetraphenylphosphorane,acmc-1ce9k,tetraphenylphosphorus bromide PubChem CID: 2724163 IUPAC Name: tetraphenylphosphanium bromide SMILES: [Br-].C1=CC=C(C=C1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 2724163
CAS 2751-90-8
Molecular Weight (g/mol) 419.30
MDL Number MFCD00011915
SMILES [Br-].C1=CC=C(C=C1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym tetraphenylphosphonium bromide,phosphonium, tetraphenyl-, bromide,tetraphenylphosphoniumbromide,tetraphenylphosponium bromide,tetraphenylphosphanium bromide,phosphonium, tetraphenyl-, bromide 1:1,ph4pbr,bromotetraphenylphosphorane,acmc-1ce9k,tetraphenylphosphorus bromide
IUPAC Name tetraphenylphosphanium bromide
InChI Key BRKFQVAOMSWFDU-UHFFFAOYSA-M
Molecular Formula C24H20BrP
8,970

2-Methoxy-4-nitrotoluene 98.0+%, TCI America™
SDP

CAS: 13120-77-9 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.16 MDL Number: MFCD00043912 InChI Key: WVQGZNRUEVFXKR-UHFFFAOYSA-N Synonym: 1-Methoxy-2-methyl-5-nitrobenzene, 2-Methyl-5-nitroanisole PubChem CID: 83159 IUPAC Name: 2-methoxy-1-methyl-4-nitrobenzene SMILES: COC1=CC(=CC=C1C)[N+]([O-])=O

PubChem CID 83159
CAS 13120-77-9
Molecular Weight (g/mol) 167.16
MDL Number MFCD00043912
SMILES COC1=CC(=CC=C1C)[N+]([O-])=O
Synonym 1-Methoxy-2-methyl-5-nitrobenzene, 2-Methyl-5-nitroanisole
IUPAC Name 2-methoxy-1-methyl-4-nitrobenzene
InChI Key WVQGZNRUEVFXKR-UHFFFAOYSA-N
Molecular Formula C8H9NO3