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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)
Pyrenes (277)
Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (16)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (6)

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3,391 – 3,405 of 159,106 results
3,391
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Terephthaldicarboxaldehyde, 98%

CAS: 623-27-8 Molecular Formula: C8H6O2 Molecular Weight (g/mol): 134.13 MDL Number: MFCD00006949 InChI Key: KUCOHFSKRZZVRO-UHFFFAOYSA-N Synonym: 1,4-benzenedicarboxaldehyde,p-phthalaldehyde,terephthaldehyde,terephthaldialdehyde,terephthaladehyde,terephthaldicarboxaldehyde,terephthalic aldehyde,1,4-phthalaldehyde,p-formylbenzaldehyde,terephtaldehyde PubChem CID: 12173 IUPAC Name: terephthalaldehyde SMILES: C1=CC(=CC=C1C=O)C=O

PubChem CID 12173
CAS 623-27-8
Molecular Weight (g/mol) 134.13
MDL Number MFCD00006949
SMILES C1=CC(=CC=C1C=O)C=O
Synonym 1,4-benzenedicarboxaldehyde,p-phthalaldehyde,terephthaldehyde,terephthaldialdehyde,terephthaladehyde,terephthaldicarboxaldehyde,terephthalic aldehyde,1,4-phthalaldehyde,p-formylbenzaldehyde,terephtaldehyde
IUPAC Name terephthalaldehyde
InChI Key KUCOHFSKRZZVRO-UHFFFAOYSA-N
Molecular Formula C8H6O2
3,392
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2,4-Dimethoxybenzylamine, 98%

CAS: 20781-20-8 Molecular Formula: C9H13NO2 Molecular Weight (g/mol): 167.21 MDL Number: MFCD00052393 InChI Key: QOWBXWFYRXSBAS-UHFFFAOYSA-N Synonym: 2,4-dimethoxybenzylamine,2,4-dimethoxyphenyl methanamine,2,4-dimethoxy benzylamine,1-2,4-dimethoxyphenyl methanamine,benzenemethanamine, 2,4-dimethoxy,2,4-dimethoxybenzyl amine,2,4-dimethoxyphenyl methylamine,2, 4-dimethoxybenzylamine,pubchem7398,2,4dimethoxybenzylamine PubChem CID: 597250 IUPAC Name: (2,4-dimethoxyphenyl)methanamine SMILES: COC1=CC(=C(C=C1)CN)OC

PubChem CID 597250
CAS 20781-20-8
Molecular Weight (g/mol) 167.21
MDL Number MFCD00052393
SMILES COC1=CC(=C(C=C1)CN)OC
Synonym 2,4-dimethoxybenzylamine,2,4-dimethoxyphenyl methanamine,2,4-dimethoxy benzylamine,1-2,4-dimethoxyphenyl methanamine,benzenemethanamine, 2,4-dimethoxy,2,4-dimethoxybenzyl amine,2,4-dimethoxyphenyl methylamine,2, 4-dimethoxybenzylamine,pubchem7398,2,4dimethoxybenzylamine
IUPAC Name (2,4-dimethoxyphenyl)methanamine
InChI Key QOWBXWFYRXSBAS-UHFFFAOYSA-N
Molecular Formula C9H13NO2
3,393
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3-Methylbenzylamine, 98%

CAS: 100-81-2 Molecular Formula: C8H11N Molecular Weight (g/mol): 121.18 MDL Number: MFCD00008118 InChI Key: RGXUCUWVGKLACF-UHFFFAOYSA-N Synonym: 3-methylbenzylamine,m-tolylmethanamine,3-methylphenyl methanamine,benzenemethanamine, 3-methyl,m-methylbenzylamine,1-3-methylphenyl methanamine,3-methylbenzyl amine,alpha-amino-m-xylene,benzylamine, m-methyl,m-xylylamine PubChem CID: 66015 IUPAC Name: (3-methylphenyl)methanamine SMILES: CC1=CC(=CC=C1)CN

PubChem CID 66015
CAS 100-81-2
Molecular Weight (g/mol) 121.18
MDL Number MFCD00008118
SMILES CC1=CC(=CC=C1)CN
Synonym 3-methylbenzylamine,m-tolylmethanamine,3-methylphenyl methanamine,benzenemethanamine, 3-methyl,m-methylbenzylamine,1-3-methylphenyl methanamine,3-methylbenzyl amine,alpha-amino-m-xylene,benzylamine, m-methyl,m-xylylamine
IUPAC Name (3-methylphenyl)methanamine
InChI Key RGXUCUWVGKLACF-UHFFFAOYSA-N
Molecular Formula C8H11N
3,394
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Benzylamine hydrochloride, 99%

CAS: 3287-99-8 Molecular Formula: C7H9N·ClH Molecular Weight (g/mol): 143.62 MDL Number: MFCD00012852 InChI Key: XKXHCNPAFAXVRZ-UHFFFAOYSA-N Synonym: benzylamine hydrochloride,phenylmethanamine hydrochloride,benzenemethanamine, hydrochloride,benzylammonium chloride,benzylamine, hydrochloride,usaf el-82,benzenemethanamine, hydrochloride 1:1,benzylamine hcl,benzylaminehydrochloride,benzyl amine hcl salt PubChem CID: 2724127 IUPAC Name: phenylmethanamine;hydrochloride SMILES: C1=CC=C(C=C1)CN.Cl

PubChem CID 2724127
CAS 3287-99-8
Molecular Weight (g/mol) 143.62
MDL Number MFCD00012852
SMILES C1=CC=C(C=C1)CN.Cl
Synonym benzylamine hydrochloride,phenylmethanamine hydrochloride,benzenemethanamine, hydrochloride,benzylammonium chloride,benzylamine, hydrochloride,usaf el-82,benzenemethanamine, hydrochloride 1:1,benzylamine hcl,benzylaminehydrochloride,benzyl amine hcl salt
IUPAC Name phenylmethanamine;hydrochloride
InChI Key XKXHCNPAFAXVRZ-UHFFFAOYSA-N
Molecular Formula C7H9N·ClH
3,395
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2,4-Dichloro-6-methylbenzylamine, 98+%, Thermo Scientific™

CAS: 150517-76-3 Molecular Formula: C8H9Cl2N Molecular Weight (g/mol): 190.07 MDL Number: MFCD00052913 InChI Key: QISTWSMZJRTDCS-UHFFFAOYSA-N Synonym: 2,4-dichloro-6-methylbenzylamine,2,4-dichloro-6-methylphenyl methanamine,2,4-dichloro-6-methylphenyl methylamine,benzenemethanamine,2,4-dichloro-6-methyl,benzenemethanamine, 2,4-dichloro-6-methyl,2,4-dichloro-6-methylbenzyl amine hydrochloride,4,6-dichloro-2-methylbenzylamine,acmc-1c3je,2-aminomethyl-3,5-dichlorotoluene,1-2,4-dichloro-6-methylphenyl methanamine PubChem CID: 2800971 SMILES: CC1=CC(Cl)=CC(Cl)=C1CN

PubChem CID 2800971
CAS 150517-76-3
Molecular Weight (g/mol) 190.07
MDL Number MFCD00052913
SMILES CC1=CC(Cl)=CC(Cl)=C1CN
Synonym 2,4-dichloro-6-methylbenzylamine,2,4-dichloro-6-methylphenyl methanamine,2,4-dichloro-6-methylphenyl methylamine,benzenemethanamine,2,4-dichloro-6-methyl,benzenemethanamine, 2,4-dichloro-6-methyl,2,4-dichloro-6-methylbenzyl amine hydrochloride,4,6-dichloro-2-methylbenzylamine,acmc-1c3je,2-aminomethyl-3,5-dichlorotoluene,1-2,4-dichloro-6-methylphenyl methanamine
InChI Key QISTWSMZJRTDCS-UHFFFAOYSA-N
Molecular Formula C8H9Cl2N
3,396
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4-Methoxy-N-methylbenzylamine, 95%

CAS: 702-24-9 Molecular Formula: C9H13NO Molecular Weight (g/mol): 151.21 InChI Key: AIJFPNKGGAPZFJ-UHFFFAOYSA-N Synonym: 4-methoxy-n-methylbenzylamine,n-4-methoxybenzyl-n-methylamine,n-methyl-4-methoxybenzylamine,1-4-methoxyphenyl-n-methylmethanamine,4-methoxyphenyl methyl methyl amine,benzenemethanamine, 4-methoxy-n-methyl,4-methoxy-benzyl-methyl-amine,4-methoxyphenyl-n-methylmethanamine,n-methyl-p-methoxybenzylamine,1-4-methoxyphenyl-n-methyl-methanamine PubChem CID: 485407 IUPAC Name: 1-(4-methoxyphenyl)-N-methylmethanamine SMILES: CNCC1=CC=C(C=C1)OC

PubChem CID 485407
CAS 702-24-9
Molecular Weight (g/mol) 151.21
SMILES CNCC1=CC=C(C=C1)OC
Synonym 4-methoxy-n-methylbenzylamine,n-4-methoxybenzyl-n-methylamine,n-methyl-4-methoxybenzylamine,1-4-methoxyphenyl-n-methylmethanamine,4-methoxyphenyl methyl methyl amine,benzenemethanamine, 4-methoxy-n-methyl,4-methoxy-benzyl-methyl-amine,4-methoxyphenyl-n-methylmethanamine,n-methyl-p-methoxybenzylamine,1-4-methoxyphenyl-n-methyl-methanamine
IUPAC Name 1-(4-methoxyphenyl)-N-methylmethanamine
InChI Key AIJFPNKGGAPZFJ-UHFFFAOYSA-N
Molecular Formula C9H13NO
3,397

3-[(6-Methylpyrazin-2-yl)oxy]benzylamine, 97%, Thermo Scientific™

CAS: 941716-89-8 Molecular Formula: C12H13N3O Molecular Weight (g/mol): 215.256 MDL Number: MFCD09817526 InChI Key: PJVRJIDLKXDROC-UHFFFAOYSA-N Synonym: 3-6-methylpyrazin-2-yl oxy benzylamine,3-6-methylpyrazin-2-yl oxy phenyl methanamine,1-3-6-methylpyrazin-2-yl oxy phenyl methanamine,3-6-methylpyrazin-2-yloxy phenyl methylamine,3-6-methylpyrazin-2-yl oxy phenyl methylamine PubChem CID: 24229681 IUPAC Name: [3-(6-methylpyrazin-2-yl)oxyphenyl]methanamine SMILES: CC1=CN=CC(=N1)OC2=CC=CC(=C2)CN

PubChem CID 24229681
CAS 941716-89-8
Molecular Weight (g/mol) 215.256
MDL Number MFCD09817526
SMILES CC1=CN=CC(=N1)OC2=CC=CC(=C2)CN
Synonym 3-6-methylpyrazin-2-yl oxy benzylamine,3-6-methylpyrazin-2-yl oxy phenyl methanamine,1-3-6-methylpyrazin-2-yl oxy phenyl methanamine,3-6-methylpyrazin-2-yloxy phenyl methylamine,3-6-methylpyrazin-2-yl oxy phenyl methylamine
IUPAC Name [3-(6-methylpyrazin-2-yl)oxyphenyl]methanamine
InChI Key PJVRJIDLKXDROC-UHFFFAOYSA-N
Molecular Formula C12H13N3O
3,398
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2-(N,N-Dimethylaminomethyl)phenylboronic acid, 98%, Thermo Scientific Chemicals

CAS: 85107-53-5 Molecular Formula: C9H14BNO2 Molecular Weight (g/mol): 179.02 MDL Number: MFCD01318999 InChI Key: VUDCTLOJEPCNRS-UHFFFAOYSA-N Synonym: 2-dimethylamino methyl phenyl boronic acid,2-n,n-dimethylaminomethyl phenylboronic acid,2-dimethylamino methyl phenylboronic acid,boronic acid, 2-dimethylamino methyl phenyl,2-n,n-dimethylaminomethyl benzeneboronic acid,2-n,n-dimethylaminomethyl phenyl-boronic acid,2-dimethylamino methyl phenyl boranediol,2-dimethylamino methyl benzeneboronic acid PubChem CID: 2734345 IUPAC Name: [2-[(dimethylamino)methyl]phenyl]boronic acid SMILES: B(C1=CC=CC=C1CN(C)C)(O)O

PubChem CID 2734345
CAS 85107-53-5
Molecular Weight (g/mol) 179.02
MDL Number MFCD01318999
SMILES B(C1=CC=CC=C1CN(C)C)(O)O
Synonym 2-dimethylamino methyl phenyl boronic acid,2-n,n-dimethylaminomethyl phenylboronic acid,2-dimethylamino methyl phenylboronic acid,boronic acid, 2-dimethylamino methyl phenyl,2-n,n-dimethylaminomethyl benzeneboronic acid,2-n,n-dimethylaminomethyl phenyl-boronic acid,2-dimethylamino methyl phenyl boranediol,2-dimethylamino methyl benzeneboronic acid
IUPAC Name [2-[(dimethylamino)methyl]phenyl]boronic acid
InChI Key VUDCTLOJEPCNRS-UHFFFAOYSA-N
Molecular Formula C9H14BNO2
3,399
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2,4-Dimethoxybenzylamine, 98%

CAS: 20781-20-8 Molecular Formula: C9H13NO2 Molecular Weight (g/mol): 167.208 MDL Number: MFCD00052393 InChI Key: QOWBXWFYRXSBAS-UHFFFAOYSA-N PubChem CID: 597250 IUPAC Name: (2,4-dimethoxyphenyl)methanamine SMILES: COC1=CC(=C(C=C1)CN)OC

PubChem CID 597250
CAS 20781-20-8
Molecular Weight (g/mol) 167.208
MDL Number MFCD00052393
SMILES COC1=CC(=C(C=C1)CN)OC
IUPAC Name (2,4-dimethoxyphenyl)methanamine
InChI Key QOWBXWFYRXSBAS-UHFFFAOYSA-N
Molecular Formula C9H13NO2
3,400

4-(1H-Imidazol-1-ylmethyl)-N-methylbenzylamine 1.5 oxalate 0.5 hydrate, 97%, Thermo Scientific™

CAS: 910036-84-9 Molecular Formula: C14H17N3O4 Molecular Weight (g/mol): 291.307 MDL Number: MFCD09064952 InChI Key: AIQAEMDKVTYASZ-UHFFFAOYSA-N Synonym: oxalic acid; 4-imidazol-1-ylmethyl phenyl methyl methyl amine,oxalic acid-1-4-1h-imidazol-1-yl methyl phenyl-n-methylmethanamine 1/1 PubChem CID: 24229491 IUPAC Name: 1-[4-(imidazol-1-ylmethyl)phenyl]-N-methylmethanamine;oxalic acid SMILES: CNCC1=CC=C(C=C1)CN2C=CN=C2.C(=O)(C(=O)O)O

PubChem CID 24229491
CAS 910036-84-9
Molecular Weight (g/mol) 291.307
MDL Number MFCD09064952
SMILES CNCC1=CC=C(C=C1)CN2C=CN=C2.C(=O)(C(=O)O)O
Synonym oxalic acid; 4-imidazol-1-ylmethyl phenyl methyl methyl amine,oxalic acid-1-4-1h-imidazol-1-yl methyl phenyl-n-methylmethanamine 1/1
IUPAC Name 1-[4-(imidazol-1-ylmethyl)phenyl]-N-methylmethanamine;oxalic acid
InChI Key AIQAEMDKVTYASZ-UHFFFAOYSA-N
Molecular Formula C14H17N3O4
3,401

(3-Thien-3-ylphenyl)methylamine, 97%, Thermo Scientific™

CAS: 138139-99-8 Molecular Formula: C11H11NS Molecular Weight (g/mol): 189.276 MDL Number: MFCD08690276 InChI Key: GBUXQFDNGWGBJH-UHFFFAOYSA-N Synonym: 3-thien-3-ylphenyl methylamine,3-thiophen-3-yl phenyl methanamine,1-3-thiophen-3-yl phenyl methanamine,3-thiophen-3-yl-benzylamine,3-3-thienyl phenyl methylamine,3-thiophen-3-ylphenyl methylamine PubChem CID: 19916941 IUPAC Name: (3-thiophen-3-ylphenyl)methanamine SMILES: C1=CC(=CC(=C1)CN)C2=CSC=C2

PubChem CID 19916941
CAS 138139-99-8
Molecular Weight (g/mol) 189.276
MDL Number MFCD08690276
SMILES C1=CC(=CC(=C1)CN)C2=CSC=C2
Synonym 3-thien-3-ylphenyl methylamine,3-thiophen-3-yl phenyl methanamine,1-3-thiophen-3-yl phenyl methanamine,3-thiophen-3-yl-benzylamine,3-3-thienyl phenyl methylamine,3-thiophen-3-ylphenyl methylamine
IUPAC Name (3-thiophen-3-ylphenyl)methanamine
InChI Key GBUXQFDNGWGBJH-UHFFFAOYSA-N
Molecular Formula C11H11NS
3,402
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2-Bromo-6-chlorobenzaldehyde, 98%

CAS: 64622-16-8 Molecular Formula: C7H4BrClO Molecular Weight (g/mol): 219.462 MDL Number: MFCD00266792 InChI Key: NUGMENVSVAURGO-UHFFFAOYSA-N Synonym: 2-chloro-6-bromobenzaldehyde,benzaldehyde, 2-bromo-6-chloro,2-bromo-6-chloro-benzaldehyde PubChem CID: 13524042 IUPAC Name: 2-bromo-6-chlorobenzaldehyde SMILES: C1=CC(=C(C(=C1)Br)C=O)Cl

PubChem CID 13524042
CAS 64622-16-8
Molecular Weight (g/mol) 219.462
MDL Number MFCD00266792
SMILES C1=CC(=C(C(=C1)Br)C=O)Cl
Synonym 2-chloro-6-bromobenzaldehyde,benzaldehyde, 2-bromo-6-chloro,2-bromo-6-chloro-benzaldehyde
IUPAC Name 2-bromo-6-chlorobenzaldehyde
InChI Key NUGMENVSVAURGO-UHFFFAOYSA-N
Molecular Formula C7H4BrClO
3,403

3-(1-Methyl-1H-pyrazol-3-yl)benzoic acid, 97%, Thermo Scientific™

CAS: 906352-85-0 Molecular Formula: C11H10N2O2 Molecular Weight (g/mol): 202.213 MDL Number: MFCD09065006 InChI Key: NQPMBEUYTBLTAG-UHFFFAOYSA-N Synonym: 3-1-methyl-1h-pyrazol-3-yl benzoic acid,3-1-methylpyrazol-3-yl benzoic acid,benzoicacid,3-1-methyl-1h-pyrazol-3-yl,3-3-carboxyphenyl-1-methyl-1h-pyrazole,benzoicacid, 3-1-methyl-1h-pyrazol-3-yl,benzoic acid, 3-1-methyl-1h-pyrazol-3-yl PubChem CID: 24229627 IUPAC Name: 3-(1-methylpyrazol-3-yl)benzoic acid SMILES: CN1C=CC(=N1)C2=CC(=CC=C2)C(=O)O

PubChem CID 24229627
CAS 906352-85-0
Molecular Weight (g/mol) 202.213
MDL Number MFCD09065006
SMILES CN1C=CC(=N1)C2=CC(=CC=C2)C(=O)O
Synonym 3-1-methyl-1h-pyrazol-3-yl benzoic acid,3-1-methylpyrazol-3-yl benzoic acid,benzoicacid,3-1-methyl-1h-pyrazol-3-yl,3-3-carboxyphenyl-1-methyl-1h-pyrazole,benzoicacid, 3-1-methyl-1h-pyrazol-3-yl,benzoic acid, 3-1-methyl-1h-pyrazol-3-yl
IUPAC Name 3-(1-methylpyrazol-3-yl)benzoic acid
InChI Key NQPMBEUYTBLTAG-UHFFFAOYSA-N
Molecular Formula C11H10N2O2
3,404
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Benzoyl isothiocyanate, 98%

CAS: 532-55-8 Molecular Formula: C8H5NOS Molecular Weight (g/mol): 163.2 MDL Number: MFCD00004815 InChI Key: CPEKAXYCDKETEN-UHFFFAOYSA-N Synonym: benzoylthiocarbimide,benzoylisothiocyanate,benzoylisothiocyante,isothiocyanic acid benzoyl ester,unii-u8j7q32b86,n-benzoyl isothiocyanate,benzoic acid, anhydride with hncs,benzoic acid, anhydride with isothiocyanic acid,oxophenylmethanisothiocyanate,1-benzoyl acetone PubChem CID: 68284 IUPAC Name: benzoyl isothiocyanate SMILES: C1=CC=C(C=C1)C(=O)N=C=S

PubChem CID 68284
CAS 532-55-8
Molecular Weight (g/mol) 163.2
MDL Number MFCD00004815
SMILES C1=CC=C(C=C1)C(=O)N=C=S
Synonym benzoylthiocarbimide,benzoylisothiocyanate,benzoylisothiocyante,isothiocyanic acid benzoyl ester,unii-u8j7q32b86,n-benzoyl isothiocyanate,benzoic acid, anhydride with hncs,benzoic acid, anhydride with isothiocyanic acid,oxophenylmethanisothiocyanate,1-benzoyl acetone
IUPAC Name benzoyl isothiocyanate
InChI Key CPEKAXYCDKETEN-UHFFFAOYSA-N
Molecular Formula C8H5NOS
3,405
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4-(Methylthio)benzaldehyde, 97%

CAS: 3446-89-7 Molecular Formula: C8H8OS Molecular Weight (g/mol): 152.21 MDL Number: MFCD00006948 InChI Key: QRVYABWJVXXOTN-UHFFFAOYSA-N Synonym: 4-methylthio benzaldehyde,benzaldehyde, 4-methylthio,4-methylsulfanyl benzaldehyde,4-methylmercaptobenzaldehyde,p-methylthio benzaldehyde,p-methylthiobenzaldehyde,unii-1tvq11biy8,4-aldehyde thioanisole,p-methylmercaptobenzaldehyde PubChem CID: 76985 IUPAC Name: 4-methylsulfanylbenzaldehyde SMILES: CSC1=CC=C(C=C1)C=O

PubChem CID 76985
CAS 3446-89-7
Molecular Weight (g/mol) 152.21
MDL Number MFCD00006948
SMILES CSC1=CC=C(C=C1)C=O
Synonym 4-methylthio benzaldehyde,benzaldehyde, 4-methylthio,4-methylsulfanyl benzaldehyde,4-methylmercaptobenzaldehyde,p-methylthio benzaldehyde,p-methylthiobenzaldehyde,unii-1tvq11biy8,4-aldehyde thioanisole,p-methylmercaptobenzaldehyde
IUPAC Name 4-methylsulfanylbenzaldehyde
InChI Key QRVYABWJVXXOTN-UHFFFAOYSA-N
Molecular Formula C8H8OS