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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 (67,941)
Phenols (13,626)
Naphthalenes (5,098)
Fluorenes (1,235)
Unsubstituted Phenols (1,166)
Thiophenols (617)
Phenol esters (564)
Anthracenes (419)
Phenanthrenes and derivatives (332)
Tetralins (327)
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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3,781 – 3,795 of 79,013 results
3,781

2-Methoxyphenylacetic acid, 99%

CAS: 93-25-4 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00004321 InChI Key: IVEWTCACRDEAOB-UHFFFAOYSA-N Synonym: 2-methoxyphenylacetic acid,benzeneacetic acid, 2-methoxy,2-2-methoxyphenyl acetic acid,2-methoxyphenylaceticacid,o-methoxyphenyl acetic acid,acetic acid, o-methoxyphenyl,2-methoxyphenyl acetic acid,o-methoxyphenylacetic acid,acmc-209rku,2-carboxymethyl anisole PubChem CID: 7134 IUPAC Name: 2-(2-methoxyphenyl)acetic acid SMILES: COC1=CC=CC=C1CC(O)=O

PubChem CID 7134
CAS 93-25-4
Molecular Weight (g/mol) 166.18
MDL Number MFCD00004321
SMILES COC1=CC=CC=C1CC(O)=O
Synonym 2-methoxyphenylacetic acid,benzeneacetic acid, 2-methoxy,2-2-methoxyphenyl acetic acid,2-methoxyphenylaceticacid,o-methoxyphenyl acetic acid,acetic acid, o-methoxyphenyl,2-methoxyphenyl acetic acid,o-methoxyphenylacetic acid,acmc-209rku,2-carboxymethyl anisole
IUPAC Name 2-(2-methoxyphenyl)acetic acid
InChI Key IVEWTCACRDEAOB-UHFFFAOYSA-N
Molecular Formula C9H10O3
3,782

1,3,5-Trimethoxybenzene, 99%

CAS: 621-23-8 Molecular Formula: C9H12O3 Molecular Weight (g/mol): 168.19 MDL Number: MFCD00008385 InChI Key: LKUDPHPHKOZXCD-UHFFFAOYSA-N Synonym: phloroglucinol trimethyl ether,sym-trimethoxybenzene,benzene, 1,3,5-trimethoxy,1,3,5-trimethyoxybenzene,unii-00vji3vg3d,1,3,5-trimethoxy benzene,o,o,o-1,3,5-trimethylresorcinol,00vji3vg3d,dsstox_cid_25963,dsstox_rid_81259 PubChem CID: 69301 ChEBI: CHEBI:31038 IUPAC Name: 1,3,5-trimethoxybenzene SMILES: COC1=CC(OC)=CC(OC)=C1

PubChem CID 69301
CAS 621-23-8
Molecular Weight (g/mol) 168.19
ChEBI CHEBI:31038
MDL Number MFCD00008385
SMILES COC1=CC(OC)=CC(OC)=C1
Synonym phloroglucinol trimethyl ether,sym-trimethoxybenzene,benzene, 1,3,5-trimethoxy,1,3,5-trimethyoxybenzene,unii-00vji3vg3d,1,3,5-trimethoxy benzene,o,o,o-1,3,5-trimethylresorcinol,00vji3vg3d,dsstox_cid_25963,dsstox_rid_81259
IUPAC Name 1,3,5-trimethoxybenzene
InChI Key LKUDPHPHKOZXCD-UHFFFAOYSA-N
Molecular Formula C9H12O3
3,783

4-Methoxy-alpha-toluenethiol, 95%, Thermo Scientific Chemicals

CAS: 6258-60-2 Molecular Formula: C8H10OS Molecular Weight (g/mol): 154.23 MDL Number: MFCD00004871 InChI Key: PTDVPWWJRCOIIO-UHFFFAOYSA-N Synonym: 4-methoxybenzyl mercaptan,4-methoxy-alpha-toluenethiol,4-methoxybenzylmercaptan,4-methoxyphenyl methanethiol,4-methoxy benzylmercaptan,4-methoxybenzenemethanethiol,benzenemethanethiol, 4-methoxy,p-methoxybenzyl mercaptan,p-methoxybenzylthiol,p-methoxybenzylmercaptan PubChem CID: 80407 IUPAC Name: (4-methoxyphenyl)methanethiol SMILES: COC1=CC=C(CS)C=C1

PubChem CID 80407
CAS 6258-60-2
Molecular Weight (g/mol) 154.23
MDL Number MFCD00004871
SMILES COC1=CC=C(CS)C=C1
Synonym 4-methoxybenzyl mercaptan,4-methoxy-alpha-toluenethiol,4-methoxybenzylmercaptan,4-methoxyphenyl methanethiol,4-methoxy benzylmercaptan,4-methoxybenzenemethanethiol,benzenemethanethiol, 4-methoxy,p-methoxybenzyl mercaptan,p-methoxybenzylthiol,p-methoxybenzylmercaptan
IUPAC Name (4-methoxyphenyl)methanethiol
InChI Key PTDVPWWJRCOIIO-UHFFFAOYSA-N
Molecular Formula C8H10OS
3,784

2,3-Difluoro-4-hydroxybenzonitrile, 95%, Thermo Scientific Chemicals

CAS: 126162-38-7 Molecular Formula: C7H3F2NO Molecular Weight (g/mol): 155.10 MDL Number: MFCD00269596 InChI Key: UIJJJWADIVZXNT-UHFFFAOYSA-N PubChem CID: 2736978 IUPAC Name: 2,3-difluoro-4-hydroxybenzonitrile SMILES: OC1=C(F)C(F)=C(C=C1)C#N

PubChem CID 2736978
CAS 126162-38-7
Molecular Weight (g/mol) 155.10
MDL Number MFCD00269596
SMILES OC1=C(F)C(F)=C(C=C1)C#N
IUPAC Name 2,3-difluoro-4-hydroxybenzonitrile
InChI Key UIJJJWADIVZXNT-UHFFFAOYSA-N
Molecular Formula C7H3F2NO
3,785

2-Fluoro-4-nitrophenol, 98+%

CAS: 403-19-0 Molecular Formula: C6H4FNO3 Molecular Weight (g/mol): 157.1 MDL Number: MFCD00051970 InChI Key: ORPHLVJBJOCHBR-UHFFFAOYSA-N Synonym: 2-fluoro-4-nitrophenol,phenol, 2-fluoro-4-nitro,3-fluoro-4-hydroxynitrobenzene,2-fluoro-4-nitro-phenol,pubchem4122,4-nitro-2-fluorophenol,2-fluoro-4-nitro phenol,acmc-1cb9t,ksc493s7t PubChem CID: 9825 SMILES: C1=CC(=C(C=C1[N+](=O)[O-])F)O

PubChem CID 9825
CAS 403-19-0
Molecular Weight (g/mol) 157.1
MDL Number MFCD00051970
SMILES C1=CC(=C(C=C1[N+](=O)[O-])F)O
Synonym 2-fluoro-4-nitrophenol,phenol, 2-fluoro-4-nitro,3-fluoro-4-hydroxynitrobenzene,2-fluoro-4-nitro-phenol,pubchem4122,4-nitro-2-fluorophenol,2-fluoro-4-nitro phenol,acmc-1cb9t,ksc493s7t
InChI Key ORPHLVJBJOCHBR-UHFFFAOYSA-N
Molecular Formula C6H4FNO3
3,786

2,3,5,6-Tetrafluoroanisole, 97%

CAS: 2324-98-3 Molecular Formula: C7H4F4O Molecular Weight (g/mol): 180.10 MDL Number: MFCD00000311 InChI Key: AXCOCGJDERQVDK-UHFFFAOYSA-N Synonym: 2,3,5,6-tetrafluoroanisole,2,3,5,6-tetrafluoromethoxy benzene,anisole, 2,3,5,6-tetrafluoro,2,3,5,6-tetrafluoromethoxybenzene,methyl 2,3,5,6-tetrafluorophenyl ether,benzene, 1,2,4,5-tetrafluoro-3-methoxy,1,2,4,5-tetrafluoro-3-methoxy-benzene,pubchem10114,acmc-1clho,2,3,5,6-tetrafluoro-anisole PubChem CID: 75351 IUPAC Name: 1,2,4,5-tetrafluoro-3-methoxybenzene SMILES: COC1=C(F)C(F)=CC(F)=C1F

PubChem CID 75351
CAS 2324-98-3
Molecular Weight (g/mol) 180.10
MDL Number MFCD00000311
SMILES COC1=C(F)C(F)=CC(F)=C1F
Synonym 2,3,5,6-tetrafluoroanisole,2,3,5,6-tetrafluoromethoxy benzene,anisole, 2,3,5,6-tetrafluoro,2,3,5,6-tetrafluoromethoxybenzene,methyl 2,3,5,6-tetrafluorophenyl ether,benzene, 1,2,4,5-tetrafluoro-3-methoxy,1,2,4,5-tetrafluoro-3-methoxy-benzene,pubchem10114,acmc-1clho,2,3,5,6-tetrafluoro-anisole
IUPAC Name 1,2,4,5-tetrafluoro-3-methoxybenzene
InChI Key AXCOCGJDERQVDK-UHFFFAOYSA-N
Molecular Formula C7H4F4O
3,787

1,2,3-Trimethoxybenzene, 98%

CAS: 634-36-6 Molecular Formula: C9H12O3 Molecular Weight (g/mol): 168.19 MDL Number: MFCD00008358 InChI Key: CRUILBNAQILVHZ-UHFFFAOYSA-N Synonym: methylsyringol,pyrogallol trimethyl ether,trimethoxybenzene,benzene, 1,2,3-trimethoxy,tri-o-methylpyrogallol,benzene, trimethoxy,unii-mre1o894fg,1,2,3-trimethoxy benzene,mre1o894fg,3,4,5-trimethoxybenzene PubChem CID: 12462 ChEBI: CHEBI:86529 IUPAC Name: 1,2,3-trimethoxybenzene SMILES: COC1=C(C(=CC=C1)OC)OC

PubChem CID 12462
CAS 634-36-6
Molecular Weight (g/mol) 168.19
ChEBI CHEBI:86529
MDL Number MFCD00008358
SMILES COC1=C(C(=CC=C1)OC)OC
Synonym methylsyringol,pyrogallol trimethyl ether,trimethoxybenzene,benzene, 1,2,3-trimethoxy,tri-o-methylpyrogallol,benzene, trimethoxy,unii-mre1o894fg,1,2,3-trimethoxy benzene,mre1o894fg,3,4,5-trimethoxybenzene
IUPAC Name 1,2,3-trimethoxybenzene
InChI Key CRUILBNAQILVHZ-UHFFFAOYSA-N
Molecular Formula C9H12O3
3,788

4-Iodophenol, 99%

CAS: 540-38-5 Molecular Formula: C6H5IO Molecular Weight (g/mol): 220.01 MDL Number: MFCD00002327 InChI Key: VSMDINRNYYEDRN-UHFFFAOYSA-N Synonym: p-iodophenol,phenol, 4-iodo,phenol, p-iodo,4-hydroxyiodobenzene,p-hydroxyiodobenzene,4-hydroxyphenyl iodide,4-iodo-phenol,unii-bh194bak0b,ccris 668,bh194bak0b PubChem CID: 10894 ChEBI: CHEBI:43521 IUPAC Name: 4-iodophenol SMILES: OC1=CC=C(I)C=C1

PubChem CID 10894
CAS 540-38-5
Molecular Weight (g/mol) 220.01
ChEBI CHEBI:43521
MDL Number MFCD00002327
SMILES OC1=CC=C(I)C=C1
Synonym p-iodophenol,phenol, 4-iodo,phenol, p-iodo,4-hydroxyiodobenzene,p-hydroxyiodobenzene,4-hydroxyphenyl iodide,4-iodo-phenol,unii-bh194bak0b,ccris 668,bh194bak0b
IUPAC Name 4-iodophenol
InChI Key VSMDINRNYYEDRN-UHFFFAOYSA-N
Molecular Formula C6H5IO
3,789

2,3-Dibromo-4-hydroxy-5-methoxybenzaldehyde, 98%

CAS: 2973-75-3 Molecular Formula: C8H6Br2O3 Molecular Weight (g/mol): 309.94 MDL Number: MFCD00016978 InChI Key: WKLKGSHBXNPUDU-UHFFFAOYSA-N Synonym: 5,6-dibromovanillin,acmc-1chm2,2,3-dibromo-5-methoxy-4-hydroxybenzaldehyde,2,3-bis bromanyl-5-methoxy-4-oxidanyl-benzaldehyde PubChem CID: 520452 IUPAC Name: 2,3-dibromo-4-hydroxy-5-methoxybenzaldehyde SMILES: COC1=CC(C=O)=C(Br)C(Br)=C1O

PubChem CID 520452
CAS 2973-75-3
Molecular Weight (g/mol) 309.94
MDL Number MFCD00016978
SMILES COC1=CC(C=O)=C(Br)C(Br)=C1O
Synonym 5,6-dibromovanillin,acmc-1chm2,2,3-dibromo-5-methoxy-4-hydroxybenzaldehyde,2,3-bis bromanyl-5-methoxy-4-oxidanyl-benzaldehyde
IUPAC Name 2,3-dibromo-4-hydroxy-5-methoxybenzaldehyde
InChI Key WKLKGSHBXNPUDU-UHFFFAOYSA-N
Molecular Formula C8H6Br2O3
3,790

2-Bromo-5-fluorophenol, 97%

CAS: 147460-41-1 Molecular Formula: C6H4BrFO Molecular Weight (g/mol): 190.999 MDL Number: MFCD00040939 InChI Key: HUVAOAVBKOVPBZ-UHFFFAOYSA-N Synonym: phenol, 2-bromo-5-fluoro,2-bromo-5-fluoro-phenol,pubchem1964,2-bromo-5-fluorphenol,acmc-209cyi,2-bromo-5-fluorphenol;,ksc493i7h,paragos 390207,2-bromo-5-fluorophenol,attercop-chm at106843 PubChem CID: 2724600 IUPAC Name: 2-bromo-5-fluorophenol SMILES: C1=CC(=C(C=C1F)O)Br

PubChem CID 2724600
CAS 147460-41-1
Molecular Weight (g/mol) 190.999
MDL Number MFCD00040939
SMILES C1=CC(=C(C=C1F)O)Br
Synonym phenol, 2-bromo-5-fluoro,2-bromo-5-fluoro-phenol,pubchem1964,2-bromo-5-fluorphenol,acmc-209cyi,2-bromo-5-fluorphenol;,ksc493i7h,paragos 390207,2-bromo-5-fluorophenol,attercop-chm at106843
IUPAC Name 2-bromo-5-fluorophenol
InChI Key HUVAOAVBKOVPBZ-UHFFFAOYSA-N
Molecular Formula C6H4BrFO
3,791

2,6-Dichloro-4-fluorophenol, 98%

CAS: 392-71-2 Molecular Formula: C6H3Cl2FO Molecular Weight (g/mol): 180.987 MDL Number: MFCD00010675 InChI Key: BOJVIFKSTRCIRJ-UHFFFAOYSA-N PubChem CID: 94950 IUPAC Name: 2,6-dichloro-4-fluorophenol SMILES: C1=C(C=C(C(=C1Cl)O)Cl)F

PubChem CID 94950
CAS 392-71-2
Molecular Weight (g/mol) 180.987
MDL Number MFCD00010675
SMILES C1=C(C=C(C(=C1Cl)O)Cl)F
IUPAC Name 2,6-dichloro-4-fluorophenol
InChI Key BOJVIFKSTRCIRJ-UHFFFAOYSA-N
Molecular Formula C6H3Cl2FO
3,792

p-Chlorophenol, MP Biomedicals

CAS: 106-48-9 Molecular Formula: C6H5ClO Molecular Weight (g/mol): 128.555 InChI Key: WXNZTHHGJRFXKQ-UHFFFAOYSA-N Synonym: p-chlorophenol,parachlorophenol,phenol, 4-chloro,4-hydroxychlorobenzene,phenol, p-chloro,applied 3-78,4-monochlorophenol,p-chlorophenic acid,p-chlorfenol,4-chloro-1-hydroxybenzene PubChem CID: 4684 ChEBI: CHEBI:28078 IUPAC Name: 4-chlorophenol SMILES: C1=CC(=CC=C1O)Cl

PubChem CID 4684
CAS 106-48-9
Molecular Weight (g/mol) 128.555
ChEBI CHEBI:28078
SMILES C1=CC(=CC=C1O)Cl
Synonym p-chlorophenol,parachlorophenol,phenol, 4-chloro,4-hydroxychlorobenzene,phenol, p-chloro,applied 3-78,4-monochlorophenol,p-chlorophenic acid,p-chlorfenol,4-chloro-1-hydroxybenzene
IUPAC Name 4-chlorophenol
InChI Key WXNZTHHGJRFXKQ-UHFFFAOYSA-N
Molecular Formula C6H5ClO
3,793

2-Chloro-6-nitrophenol, 98%

CAS: 603-86-1 Molecular Formula: C6H4ClNO3 Molecular Weight (g/mol): 173.55 MDL Number: MFCD00024233 InChI Key: ICCYFVWQNFMENX-UHFFFAOYSA-N Synonym: 2-chloro-6-nitrophenol,phenol, 2-chloro-6-nitro,6-chloro-2-nitrophenol,2-chloro-6-nitro-phenol,pubchem4103,2-nitro-6-chlorophenol,acmc-1aych,2-chloro-6-nitro-pheno,2-chlor-6-nitro-phenol,ksc494c1j PubChem CID: 11784 IUPAC Name: 2-chloro-6-nitrophenol SMILES: OC1=C(Cl)C=CC=C1[N+]([O-])=O

PubChem CID 11784
CAS 603-86-1
Molecular Weight (g/mol) 173.55
MDL Number MFCD00024233
SMILES OC1=C(Cl)C=CC=C1[N+]([O-])=O
Synonym 2-chloro-6-nitrophenol,phenol, 2-chloro-6-nitro,6-chloro-2-nitrophenol,2-chloro-6-nitro-phenol,pubchem4103,2-nitro-6-chlorophenol,acmc-1aych,2-chloro-6-nitro-pheno,2-chlor-6-nitro-phenol,ksc494c1j
IUPAC Name 2-chloro-6-nitrophenol
InChI Key ICCYFVWQNFMENX-UHFFFAOYSA-N
Molecular Formula C6H4ClNO3
3,794

Anisole, 99%, Extra Dry, AcroSeal™

CAS: 100-66-3 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 InChI Key: RDOXTESZEPMUJZ-UHFFFAOYSA-N Synonym: methoxybenzene,methyl phenyl ether,benzene, methoxy,anisol,phenyl methyl ether,phenoxymethane,anizol,phenol methyl ether,methoxy-benzene PubChem CID: 7519 ChEBI: CHEBI:16579 IUPAC Name: anisole SMILES: COC1=CC=CC=C1

PubChem CID 7519
CAS 100-66-3
Molecular Weight (g/mol) 108.14
ChEBI CHEBI:16579
SMILES COC1=CC=CC=C1
Synonym methoxybenzene,methyl phenyl ether,benzene, methoxy,anisol,phenyl methyl ether,phenoxymethane,anizol,phenol methyl ether,methoxy-benzene
IUPAC Name anisole
InChI Key RDOXTESZEPMUJZ-UHFFFAOYSA-N
Molecular Formula C7H8O
3,795

3-Fluoroanisole, 99%

CAS: 456-49-5 Molecular Formula: C7H7FO Molecular Weight (g/mol): 126.13 MDL Number: MFCD00000335 InChI Key: MFJNOXOAIFNSBX-UHFFFAOYSA-N Synonym: 3-fluoroanisole,m-fluoroanisole,benzene, 1-fluoro-3-methoxy,1-fluoro-3-methoxy-benzene,2-fluoro-4-methoxybenzene,fr co1 wln,3-fluoroanisol,3-fluoro-anisole,3-fluoro anisole,anisole, m-fluoro PubChem CID: 9975 IUPAC Name: 1-fluoro-3-methoxybenzene SMILES: COC1=CC=CC(F)=C1

PubChem CID 9975
CAS 456-49-5
Molecular Weight (g/mol) 126.13
MDL Number MFCD00000335
SMILES COC1=CC=CC(F)=C1
Synonym 3-fluoroanisole,m-fluoroanisole,benzene, 1-fluoro-3-methoxy,1-fluoro-3-methoxy-benzene,2-fluoro-4-methoxybenzene,fr co1 wln,3-fluoroanisol,3-fluoro-anisole,3-fluoro anisole,anisole, m-fluoro
IUPAC Name 1-fluoro-3-methoxybenzene
InChI Key MFJNOXOAIFNSBX-UHFFFAOYSA-N
Molecular Formula C7H7FO