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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)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (6)

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4,696 – 4,710 of 159,106 results
4,696
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2-Fluoro-4-methoxybenzaldehyde, 97%

CAS: 331-64-6 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00236679 InChI Key: UNWQNFJBBWXFBG-UHFFFAOYSA-N Synonym: 2-fluoro-p-anisaldehyde,2-fluoro-4-methoxy-benzaldehyde,2-fluoro-4-methoxy benzaldehyde,benzaldehyde, 2-fluoro-4-methoxy,2-fluoro-4-methoxybenzaldhyde,pubchem1447,acmc-209hyt,3-fluoro-4-formylanisole,2-fluor-4-methoxybenzaldehyd PubChem CID: 2734873 IUPAC Name: 2-fluoro-4-methoxybenzaldehyde SMILES: COC1=CC=C(C=O)C(F)=C1

PubChem CID 2734873
CAS 331-64-6
Molecular Weight (g/mol) 154.14
MDL Number MFCD00236679
SMILES COC1=CC=C(C=O)C(F)=C1
Synonym 2-fluoro-p-anisaldehyde,2-fluoro-4-methoxy-benzaldehyde,2-fluoro-4-methoxy benzaldehyde,benzaldehyde, 2-fluoro-4-methoxy,2-fluoro-4-methoxybenzaldhyde,pubchem1447,acmc-209hyt,3-fluoro-4-formylanisole,2-fluor-4-methoxybenzaldehyd
IUPAC Name 2-fluoro-4-methoxybenzaldehyde
InChI Key UNWQNFJBBWXFBG-UHFFFAOYSA-N
Molecular Formula C8H7FO2
4,697

tert-Butyl N-(3-formylbenzyl)carbamate, 90%, Thermo Scientific™

CAS: 170853-04-0 Molecular Formula: C13H17NO3 Molecular Weight (g/mol): 235.283 InChI Key: JORXNWZTJLYRQA-UHFFFAOYSA-N PubChem CID: 2794834 IUPAC Name: tert-butyl N-[(3-formylphenyl)methyl]carbamate SMILES: CC(C)(C)OC(=O)NCC1=CC=CC(=C1)C=O

PubChem CID 2794834
CAS 170853-04-0
Molecular Weight (g/mol) 235.283
SMILES CC(C)(C)OC(=O)NCC1=CC=CC(=C1)C=O
IUPAC Name tert-butyl N-[(3-formylphenyl)methyl]carbamate
InChI Key JORXNWZTJLYRQA-UHFFFAOYSA-N
Molecular Formula C13H17NO3
4,698
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3,4-Dimethylbenzaldehyde, 97%

CAS: 5973-71-7 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.18 MDL Number: MFCD00016612 InChI Key: POQJHLBMLVTHAU-UHFFFAOYSA-N Synonym: benzaldehyde, 3,4-dimethyl,unii-16g1j12arb,4-formyl-o-xylene,o-xylene-4-carboxaldehyde,3,4-dimethyl-benzaldehyde,3 pound not4-dimethylbenzaldehyde,pubchem2535,3,4 dimethyl benzaldehyde,3,4-di-methylbenzaldehyde,3,4-dimethyl benzaldehyde PubChem CID: 22278 IUPAC Name: 3,4-dimethylbenzaldehyde SMILES: CC1=C(C=C(C=C1)C=O)C

PubChem CID 22278
CAS 5973-71-7
Molecular Weight (g/mol) 134.18
MDL Number MFCD00016612
SMILES CC1=C(C=C(C=C1)C=O)C
Synonym benzaldehyde, 3,4-dimethyl,unii-16g1j12arb,4-formyl-o-xylene,o-xylene-4-carboxaldehyde,3,4-dimethyl-benzaldehyde,3 pound not4-dimethylbenzaldehyde,pubchem2535,3,4 dimethyl benzaldehyde,3,4-di-methylbenzaldehyde,3,4-dimethyl benzaldehyde
IUPAC Name 3,4-dimethylbenzaldehyde
InChI Key POQJHLBMLVTHAU-UHFFFAOYSA-N
Molecular Formula C9H10O
4,699

4-(4-Iodobenzyl)morpholine, ≥97%, Thermo Scientific™

CAS: 299159-27-6 Molecular Formula: C11H14INO Molecular Weight (g/mol): 303.143 MDL Number: MFCD04974051 InChI Key: IYDFKIKPNVVXQU-UHFFFAOYSA-N Synonym: 4-4-iodobenzyl morpholine,4-4-iodophenyl methyl morpholine,4-4-iodo-benzyl-morpholine,4-iodobenzyl morpholine,4-morpholinomethyliodobenzene PubChem CID: 2795500 IUPAC Name: 4-[(4-iodophenyl)methyl]morpholine SMILES: C1COCCN1CC2=CC=C(C=C2)I

PubChem CID 2795500
CAS 299159-27-6
Molecular Weight (g/mol) 303.143
MDL Number MFCD04974051
SMILES C1COCCN1CC2=CC=C(C=C2)I
Synonym 4-4-iodobenzyl morpholine,4-4-iodophenyl methyl morpholine,4-4-iodo-benzyl-morpholine,4-iodobenzyl morpholine,4-morpholinomethyliodobenzene
IUPAC Name 4-[(4-iodophenyl)methyl]morpholine
InChI Key IYDFKIKPNVVXQU-UHFFFAOYSA-N
Molecular Formula C11H14INO
4,700
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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
4,701
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2-Chlorobenzylamine, 97%

CAS: 89-97-4 Molecular Formula: C7H8ClN Molecular Weight (g/mol): 141.6 MDL Number: MFCD00008108 InChI Key: KDDNKZCVYQDGKE-UHFFFAOYSA-N Synonym: 2-chlorobenzylamine,2-chlorophenyl methanamine,o-chlorobenzylamine,benzenemethanamine, 2-chloro,o-chlorobenzyl amine,2-chlorobenzenemethanamine,2-chloro-benzylamine,benzylamine, o-chloro,2-chlorophenyl methylamine,unii-l790j4y7a3 PubChem CID: 66648 IUPAC Name: (2-chlorophenyl)methanamine SMILES: C1=CC=C(C(=C1)CN)Cl

PubChem CID 66648
CAS 89-97-4
Molecular Weight (g/mol) 141.6
MDL Number MFCD00008108
SMILES C1=CC=C(C(=C1)CN)Cl
Synonym 2-chlorobenzylamine,2-chlorophenyl methanamine,o-chlorobenzylamine,benzenemethanamine, 2-chloro,o-chlorobenzyl amine,2-chlorobenzenemethanamine,2-chloro-benzylamine,benzylamine, o-chloro,2-chlorophenyl methylamine,unii-l790j4y7a3
IUPAC Name (2-chlorophenyl)methanamine
InChI Key KDDNKZCVYQDGKE-UHFFFAOYSA-N
Molecular Formula C7H8ClN
4,702
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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
4,703

4-[(4-Methylpiperazin-1-yl)methyl]benzoic acid dihydrochlorideHemihydrate, 95%, Thermo Scientific™

CAS: 106261-49-8 Molecular Formula: C13H20Cl2N2O2 Molecular Weight (g/mol): 307.215 InChI Key: ISHROKOWRJDOSN-UHFFFAOYSA-N Synonym: 4-4-methylpiperazin-1-yl methyl benzoic acid dihydrochloride,4-4-methyl-1-piperazinyl methyl benzoic acid dihydrochloride,4-4-methylpiperazin-1-yl methyl,4-4-methylpiperazinomethyl benzoic acid dihydrochloride,benzoic acid, 4-4-methyl-1-piperazinyl methyl-, dihydrochloride,zlchem 396,ksc909c2h,4-4-methyl piperazino methyl benzoic acid 2hcl,4-4-methylpiperazin-1-yl methyl benzoic acid dih PubChem CID: 10335346 IUPAC Name: 4-[(4-methylpiperazin-1-yl)methyl]benzoic acid;dihydrochloride SMILES: CN1CCN(CC1)CC2=CC=C(C=C2)C(=O)O.Cl.Cl

PubChem CID 10335346
CAS 106261-49-8
Molecular Weight (g/mol) 307.215
SMILES CN1CCN(CC1)CC2=CC=C(C=C2)C(=O)O.Cl.Cl
Synonym 4-4-methylpiperazin-1-yl methyl benzoic acid dihydrochloride,4-4-methyl-1-piperazinyl methyl benzoic acid dihydrochloride,4-4-methylpiperazin-1-yl methyl,4-4-methylpiperazinomethyl benzoic acid dihydrochloride,benzoic acid, 4-4-methyl-1-piperazinyl methyl-, dihydrochloride,zlchem 396,ksc909c2h,4-4-methyl piperazino methyl benzoic acid 2hcl,4-4-methylpiperazin-1-yl methyl benzoic acid dih
IUPAC Name 4-[(4-methylpiperazin-1-yl)methyl]benzoic acid;dihydrochloride
InChI Key ISHROKOWRJDOSN-UHFFFAOYSA-N
Molecular Formula C13H20Cl2N2O2
4,704

N-Methyl-4-(phenoxymethyl)benzylamine, 95%, Thermo Scientific™

CAS: 941716-90-1 Molecular Formula: C15H17NO Molecular Weight (g/mol): 227.31 MDL Number: MFCD09879942 InChI Key: PSMWUOSOWNRPOJ-UHFFFAOYSA-N Synonym: n-methyl-4-phenoxymethyl benzylamine,methyl 4-phenoxymethyl phenyl methyl amine,n-methyl-1-4-phenoxymethyl phenyl methanamine PubChem CID: 24229704 SMILES: CNCC1=CC=C(COC2=CC=CC=C2)C=C1

PubChem CID 24229704
CAS 941716-90-1
Molecular Weight (g/mol) 227.31
MDL Number MFCD09879942
SMILES CNCC1=CC=C(COC2=CC=CC=C2)C=C1
Synonym n-methyl-4-phenoxymethyl benzylamine,methyl 4-phenoxymethyl phenyl methyl amine,n-methyl-1-4-phenoxymethyl phenyl methanamine
InChI Key PSMWUOSOWNRPOJ-UHFFFAOYSA-N
Molecular Formula C15H17NO
4,705
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3,4,5-Trimethoxybenzylamine, 96%

CAS: 18638-99-8 Molecular Formula: C10H15NO3 Molecular Weight (g/mol): 197.234 MDL Number: MFCD00017150 InChI Key: YUPUSBMJCFBHAP-UHFFFAOYSA-N Synonym: 3,4,5-trimethoxybenzylamine,3,4,5-trimethoxyphenyl methanamine,1-3,4,5-trimethoxyphenyl methanamine,benzenemethanamine, 3,4,5-trimethoxy,3,4,5-trimethoxyphenyl methylamine,1-3,4,5-trimethoxyphenyl methanamine hydrochloride,pubchem16674,acmc-1c5ez,ksc495e6b,3,4,5-trimethoxy benzylamine PubChem CID: 87736 IUPAC Name: (3,4,5-trimethoxyphenyl)methanamine SMILES: COC1=CC(=CC(=C1OC)OC)CN

PubChem CID 87736
CAS 18638-99-8
Molecular Weight (g/mol) 197.234
MDL Number MFCD00017150
SMILES COC1=CC(=CC(=C1OC)OC)CN
Synonym 3,4,5-trimethoxybenzylamine,3,4,5-trimethoxyphenyl methanamine,1-3,4,5-trimethoxyphenyl methanamine,benzenemethanamine, 3,4,5-trimethoxy,3,4,5-trimethoxyphenyl methylamine,1-3,4,5-trimethoxyphenyl methanamine hydrochloride,pubchem16674,acmc-1c5ez,ksc495e6b,3,4,5-trimethoxy benzylamine
IUPAC Name (3,4,5-trimethoxyphenyl)methanamine
InChI Key YUPUSBMJCFBHAP-UHFFFAOYSA-N
Molecular Formula C10H15NO3
4,706
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1-Benzyl-3-pyrroline, 98%

CAS: 6913-92-4 Molecular Formula: C11H13N Molecular Weight (g/mol): 159.232 MDL Number: MFCD00012324 InChI Key: LRFHKHHUKGZIGE-UHFFFAOYSA-N Synonym: 1-benzyl-3-pyrroline,1-benzyl-2,5-dihydro-1h-pyrrole,n-benzylpyrroline,n-benzyl-3-pyrroline,1h-pyrrole, 2,5-dihydro-1-phenylmethyl,maleimide-related compound 16,l-benzyl-3-pyrroline,n-benzyl 3-pyrroline,1-benzylpyrroline PubChem CID: 561506 IUPAC Name: 1-benzyl-2,5-dihydropyrrole SMILES: C1C=CCN1CC2=CC=CC=C2

PubChem CID 561506
CAS 6913-92-4
Molecular Weight (g/mol) 159.232
MDL Number MFCD00012324
SMILES C1C=CCN1CC2=CC=CC=C2
Synonym 1-benzyl-3-pyrroline,1-benzyl-2,5-dihydro-1h-pyrrole,n-benzylpyrroline,n-benzyl-3-pyrroline,1h-pyrrole, 2,5-dihydro-1-phenylmethyl,maleimide-related compound 16,l-benzyl-3-pyrroline,n-benzyl 3-pyrroline,1-benzylpyrroline
IUPAC Name 1-benzyl-2,5-dihydropyrrole
InChI Key LRFHKHHUKGZIGE-UHFFFAOYSA-N
Molecular Formula C11H13N
4,707
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4-Fluorobenzylamine, 98+%

CAS: 140-75-0 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.146 MDL Number: MFCD00008120 InChI Key: IIFVWLUQBAIPMJ-UHFFFAOYSA-N Synonym: 4-fluorobenzylamine,4-fluorophenyl methanamine,benzenemethanamine, 4-fluoro,p-fluorobenzylamine,benzylamine, p-fluoro,p-fluorobenzyl amine,4-fluoro-benzylamine,1-4-fluorophenyl methanamine,4-fluorobenzyl amine,chembl12392 PubChem CID: 67326 IUPAC Name: (4-fluorophenyl)methanamine SMILES: C1=CC(=CC=C1CN)F

PubChem CID 67326
CAS 140-75-0
Molecular Weight (g/mol) 125.146
MDL Number MFCD00008120
SMILES C1=CC(=CC=C1CN)F
Synonym 4-fluorobenzylamine,4-fluorophenyl methanamine,benzenemethanamine, 4-fluoro,p-fluorobenzylamine,benzylamine, p-fluoro,p-fluorobenzyl amine,4-fluoro-benzylamine,1-4-fluorophenyl methanamine,4-fluorobenzyl amine,chembl12392
IUPAC Name (4-fluorophenyl)methanamine
InChI Key IIFVWLUQBAIPMJ-UHFFFAOYSA-N
Molecular Formula C7H8FN
4,708
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Ethyl mesitylglyoxylate, 97%

CAS: 5524-57-2 Molecular Formula: C13H16O3 Molecular Weight (g/mol): 220.268 MDL Number: MFCD00151821 InChI Key: XRSPPFOBPRPYLD-UHFFFAOYSA-N Synonym: ethyl mesitylglyoxylate,ethyl 2-mesityl-2-oxoacetate,ethyl 2-oxo-2-2,4,6-trimethylphenyl acetate,acmc-1asq7,mesitylglyoxylic acid ethyl ester,ethyl 2,4,6-trimethylphenyl glyoxylate,alpha-oxo-2,4,6-trimethylbenzeneacetic acid ethyl ester PubChem CID: 2736481 IUPAC Name: ethyl 2-oxo-2-(2,4,6-trimethylphenyl)acetate SMILES: CCOC(=O)C(=O)C1=C(C=C(C=C1C)C)C

PubChem CID 2736481
CAS 5524-57-2
Molecular Weight (g/mol) 220.268
MDL Number MFCD00151821
SMILES CCOC(=O)C(=O)C1=C(C=C(C=C1C)C)C
Synonym ethyl mesitylglyoxylate,ethyl 2-mesityl-2-oxoacetate,ethyl 2-oxo-2-2,4,6-trimethylphenyl acetate,acmc-1asq7,mesitylglyoxylic acid ethyl ester,ethyl 2,4,6-trimethylphenyl glyoxylate,alpha-oxo-2,4,6-trimethylbenzeneacetic acid ethyl ester
IUPAC Name ethyl 2-oxo-2-(2,4,6-trimethylphenyl)acetate
InChI Key XRSPPFOBPRPYLD-UHFFFAOYSA-N
Molecular Formula C13H16O3
4,709
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4-Bromobenzaldehyde, 98+%

CAS: 1122-91-4 Molecular Formula: C7H5BrO Molecular Weight (g/mol): 185.02 MDL Number: MFCD00003377 InChI Key: ZRYZBQLXDKPBDU-UHFFFAOYSA-N Synonym: p-bromobenzaldehyde,benzaldehyde, 4-bromo,benzaldehyde, p-bromo,4-bromo-benzaldehyde,4-bromo benzaldehyde,4-bromobenzylaldehyde,p-bromo benzaldehyde,unii-4l8vm24f65,4-brombenzaldehyde,4-brombenzaldehyd PubChem CID: 70741 IUPAC Name: 4-bromobenzaldehyde SMILES: C1=CC(=CC=C1C=O)Br

PubChem CID 70741
CAS 1122-91-4
Molecular Weight (g/mol) 185.02
MDL Number MFCD00003377
SMILES C1=CC(=CC=C1C=O)Br
Synonym p-bromobenzaldehyde,benzaldehyde, 4-bromo,benzaldehyde, p-bromo,4-bromo-benzaldehyde,4-bromo benzaldehyde,4-bromobenzylaldehyde,p-bromo benzaldehyde,unii-4l8vm24f65,4-brombenzaldehyde,4-brombenzaldehyd
IUPAC Name 4-bromobenzaldehyde
InChI Key ZRYZBQLXDKPBDU-UHFFFAOYSA-N
Molecular Formula C7H5BrO
4,710

p-(Dimethylamino)benzaldehyde, BAKER ANALYZED™ A.C.S. Reagent, J.T. Baker™

CAS: 100-10-7 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.19 MDL Number: MFCD00003381 InChI Key: BGNGWHSBYQYVRX-UHFFFAOYSA-N Synonym: 4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal PubChem CID: 7479 IUPAC Name: 4-(dimethylamino)benzaldehyde SMILES: CN(C)C1=CC=C(C=O)C=C1

PubChem CID 7479
CAS 100-10-7
Molecular Weight (g/mol) 149.19
MDL Number MFCD00003381
SMILES CN(C)C1=CC=C(C=O)C=C1
Synonym 4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal
IUPAC Name 4-(dimethylamino)benzaldehyde
InChI Key BGNGWHSBYQYVRX-UHFFFAOYSA-N
Molecular Formula C9H11NO