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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 (129,837)
Phenols (24,890)
Naphthalenes (6,294)
Phenol esters (4,685)
Unsubstituted Phenols (1,453)
Fluorenes (1,282)
Thiophenols (748)
Anthracenes (509)
Indanes (489)
Phenanthrenes and derivatives (364)
Tetralins (340)
Pyrenes (281)
Triphenyl compounds (280)
Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (17)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (5)

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2,626 – 2,640 of 158,358 results
2,626
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2-Amino-p-cresol, 97%

CAS: 95-84-1 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.16 MDL Number: MFCD00007699 InChI Key: ZMXYNJXDULEQCK-UHFFFAOYSA-N Synonym: 2-amino-p-cresol,2-hydroxy-5-methylaniline,phenol, 2-amino-4-methyl,3-amino-4-hydroxytoluene,6-hydroxy-m-toluidine,4-methyl-2-aminophenol,5-methyl-2-hydroxyaniline,2-amino-4-cresol,p-cresol, 2-amino,2-amino-4-methyl-phenol PubChem CID: 7264 IUPAC Name: 2-amino-4-methylphenol SMILES: CC1=CC=C(O)C(N)=C1

PubChem CID 7264
CAS 95-84-1
Molecular Weight (g/mol) 123.16
MDL Number MFCD00007699
SMILES CC1=CC=C(O)C(N)=C1
Synonym 2-amino-p-cresol,2-hydroxy-5-methylaniline,phenol, 2-amino-4-methyl,3-amino-4-hydroxytoluene,6-hydroxy-m-toluidine,4-methyl-2-aminophenol,5-methyl-2-hydroxyaniline,2-amino-4-cresol,p-cresol, 2-amino,2-amino-4-methyl-phenol
IUPAC Name 2-amino-4-methylphenol
InChI Key ZMXYNJXDULEQCK-UHFFFAOYSA-N
Molecular Formula C7H9NO
2,627
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3-Ethylamino-4-methylphenol, tech. 90%

CAS: 120-37-6 Molecular Formula: C9H13NO Molecular Weight (g/mol): 151.21 MDL Number: MFCD00002382 InChI Key: CTGSQPRDMHCIMM-UHFFFAOYSA-N Synonym: 3-ethylamino-4-methylphenol,3-ethylamino-p-cresol,phenol, 3-ethylamino-4-methyl,ccris 4639,3-ethylamino-4-methyl-phenol,unii-8002qme89h,3-ethylamino-4-cresol,3-ethylamino p-cresol,dsstox_cid_5269 PubChem CID: 8428 IUPAC Name: 3-(ethylamino)-4-methylphenol SMILES: CCNC1=CC(O)=CC=C1C

PubChem CID 8428
CAS 120-37-6
Molecular Weight (g/mol) 151.21
MDL Number MFCD00002382
SMILES CCNC1=CC(O)=CC=C1C
Synonym 3-ethylamino-4-methylphenol,3-ethylamino-p-cresol,phenol, 3-ethylamino-4-methyl,ccris 4639,3-ethylamino-4-methyl-phenol,unii-8002qme89h,3-ethylamino-4-cresol,3-ethylamino p-cresol,dsstox_cid_5269
IUPAC Name 3-(ethylamino)-4-methylphenol
InChI Key CTGSQPRDMHCIMM-UHFFFAOYSA-N
Molecular Formula C9H13NO
2,628
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4-(Methylthio)-m-cresol, 97%

CAS: 3120-74-9 Molecular Formula: C8H10OS Molecular Weight (g/mol): 154.227 MDL Number: MFCD00045773 InChI Key: VKALYYFVKBXHTF-UHFFFAOYSA-N Synonym: 3-methyl-4-methylthio phenol,4-methylthio-m-cresol,methylthiomethylphenol,mmtp,phenol, 3-methyl-4-methylthio,3-methyl-4-1-methylthio phenol,usaf ma-17,4-methylthio-3-methylphenol,m-cresol, 4-methylthio,3-methyl-4-methylsulfanyl phenol PubChem CID: 18391 ChEBI: CHEBI:38681 IUPAC Name: 3-methyl-4-methylsulfanylphenol SMILES: CC1=C(C=CC(=C1)O)SC

PubChem CID 18391
CAS 3120-74-9
Molecular Weight (g/mol) 154.227
ChEBI CHEBI:38681
MDL Number MFCD00045773
SMILES CC1=C(C=CC(=C1)O)SC
Synonym 3-methyl-4-methylthio phenol,4-methylthio-m-cresol,methylthiomethylphenol,mmtp,phenol, 3-methyl-4-methylthio,3-methyl-4-1-methylthio phenol,usaf ma-17,4-methylthio-3-methylphenol,m-cresol, 4-methylthio,3-methyl-4-methylsulfanyl phenol
IUPAC Name 3-methyl-4-methylsulfanylphenol
InChI Key VKALYYFVKBXHTF-UHFFFAOYSA-N
Molecular Formula C8H10OS
2,629
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3,5-Dibromoanthranilic acid, 98+%, Thermo Scientific™

CAS: 609-85-8 Molecular Formula: C7H5Br2NO2 Molecular Weight (g/mol): 294.93 MDL Number: MFCD00017087 InChI Key: WNABMWFLKQEGCP-UHFFFAOYSA-N Synonym: 3,5-dibromoanthranilic acid,2-amino-3,5-dibromobenzoicacid,3,5-dibromo-2-aminobenzoic acid,buttpark 89\07-50,2-amino-3,5-dibromo-benzoic acid,benzoic acid, 2-amino-3,5-dibromo,acmc-20ahts,pubchem3720,2-carboxy-4,6-dibromoaniline,ghl.pd_mitscher_leg0.1128 PubChem CID: 219491 IUPAC Name: 2-amino-3,5-dibromobenzoic acid SMILES: NC1=C(Br)C=C(Br)C=C1C(O)=O

PubChem CID 219491
CAS 609-85-8
Molecular Weight (g/mol) 294.93
MDL Number MFCD00017087
SMILES NC1=C(Br)C=C(Br)C=C1C(O)=O
Synonym 3,5-dibromoanthranilic acid,2-amino-3,5-dibromobenzoicacid,3,5-dibromo-2-aminobenzoic acid,buttpark 89\07-50,2-amino-3,5-dibromo-benzoic acid,benzoic acid, 2-amino-3,5-dibromo,acmc-20ahts,pubchem3720,2-carboxy-4,6-dibromoaniline,ghl.pd_mitscher_leg0.1128
IUPAC Name 2-amino-3,5-dibromobenzoic acid
InChI Key WNABMWFLKQEGCP-UHFFFAOYSA-N
Molecular Formula C7H5Br2NO2
2,630

2-(4-Methylperhydro-1,4-diazepin-1-yl)benzoic acid hydrochloride hemihydrate, 95%, Thermo Scientific™

CAS: 921938-77-4 Molecular Formula: C13H19ClN2O2 Molecular Weight (g/mol): 270.757 MDL Number: MFCD09065004 InChI Key: UCYNEWGETFFMQY-UHFFFAOYSA-N Synonym: 2-4-methyl-1,4-diazepan-1-yl benzoic acid hydrochloride,2-4-methyl-1,4-diazepan-1-yl benzoic acid hcl,2-4-methylhomopiperazin-1-yl benzoic acid hydrochloride hemihydrate,2-4-methyl-1,4-diazepan-1-yl benzoic acid-hydrogen chloride 1/1,2-4-methylperhydro-1,4-diazepin-1-yl benzoic acid hydrochloride 0.5 hydrate,benzoicacid, 2-hexahydro-4-methyl-1h-1,4-diazepin-1-yl-, hydrochloride 1:1,benzoicacid,2-hexahydro-4-methyl-1h-1,4-diazepin-1-yl-,hydrochloride 1:1 PubChem CID: 24229621 IUPAC Name: 2-(4-methyl-1,4-diazepan-1-yl)benzoic acid;hydrochloride SMILES: CN1CCCN(CC1)C2=CC=CC=C2C(=O)O.Cl

PubChem CID 24229621
CAS 921938-77-4
Molecular Weight (g/mol) 270.757
MDL Number MFCD09065004
SMILES CN1CCCN(CC1)C2=CC=CC=C2C(=O)O.Cl
Synonym 2-4-methyl-1,4-diazepan-1-yl benzoic acid hydrochloride,2-4-methyl-1,4-diazepan-1-yl benzoic acid hcl,2-4-methylhomopiperazin-1-yl benzoic acid hydrochloride hemihydrate,2-4-methyl-1,4-diazepan-1-yl benzoic acid-hydrogen chloride 1/1,2-4-methylperhydro-1,4-diazepin-1-yl benzoic acid hydrochloride 0.5 hydrate,benzoicacid, 2-hexahydro-4-methyl-1h-1,4-diazepin-1-yl-, hydrochloride 1:1,benzoicacid,2-hexahydro-4-methyl-1h-1,4-diazepin-1-yl-,hydrochloride 1:1
IUPAC Name 2-(4-methyl-1,4-diazepan-1-yl)benzoic acid;hydrochloride
InChI Key UCYNEWGETFFMQY-UHFFFAOYSA-N
Molecular Formula C13H19ClN2O2
2,631

4-(4-Methylpiperazino)benzoic acid, 97%, Thermo Scientific™

CAS: 86620-62-4 Molecular Formula: C12H16N2O2 Molecular Weight (g/mol): 220.272 MDL Number: MFCD02682063 InChI Key: UCFZVQHKTRSZMM-UHFFFAOYSA-N Synonym: 4-4-methylpiperazin-1-yl benzoic acid,4-4-methylpiperazino benzoic acid,4-4-methyl-piperazin-1-yl-benzoic acid,4-4-methylpiperazinyl benzoic acid,4-4-methyl-piperazino benzoic acid,benzoic acid, 4-4-methyl-1-piperazinyl,4-4-methyl-1-piperazinyl benzoic acid,pubchem10481,ksc448o3p PubChem CID: 736532 IUPAC Name: 4-(4-methylpiperazin-1-yl)benzoic acid SMILES: CN1CCN(CC1)C2=CC=C(C=C2)C(=O)O

PubChem CID 736532
CAS 86620-62-4
Molecular Weight (g/mol) 220.272
MDL Number MFCD02682063
SMILES CN1CCN(CC1)C2=CC=C(C=C2)C(=O)O
Synonym 4-4-methylpiperazin-1-yl benzoic acid,4-4-methylpiperazino benzoic acid,4-4-methyl-piperazin-1-yl-benzoic acid,4-4-methylpiperazinyl benzoic acid,4-4-methyl-piperazino benzoic acid,benzoic acid, 4-4-methyl-1-piperazinyl,4-4-methyl-1-piperazinyl benzoic acid,pubchem10481,ksc448o3p
IUPAC Name 4-(4-methylpiperazin-1-yl)benzoic acid
InChI Key UCFZVQHKTRSZMM-UHFFFAOYSA-N
Molecular Formula C12H16N2O2
2,632
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4-Chloro-2,6-dimethylphenol, 98%

CAS: 1123-63-3 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.609 MDL Number: MFCD00020138 InChI Key: VWYKSJIPZHRLNO-UHFFFAOYSA-N PubChem CID: 70747 IUPAC Name: 4-chloro-2,6-dimethylphenol SMILES: CC1=CC(=CC(=C1O)C)Cl

PubChem CID 70747
CAS 1123-63-3
Molecular Weight (g/mol) 156.609
MDL Number MFCD00020138
SMILES CC1=CC(=CC(=C1O)C)Cl
IUPAC Name 4-chloro-2,6-dimethylphenol
InChI Key VWYKSJIPZHRLNO-UHFFFAOYSA-N
Molecular Formula C8H9ClO
2,633
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2,4,5-Trimethylphenol, 99%

CAS: 496-78-6 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00020050 InChI Key: VXSCPERJHPWROZ-UHFFFAOYSA-N Synonym: pseudocumenol,phenol, 2,4,5-trimethyl,5-hydroxypseudocumene,1-hydroxy-2,4,5-trimethylbenzene,unii-3pca9e425c,acmc-1bmse,4-06-00-03247 beilstein handbook reference PubChem CID: 10335 IUPAC Name: 2,4,5-trimethylphenol SMILES: CC1=CC(=C(C=C1C)O)C

PubChem CID 10335
CAS 496-78-6
Molecular Weight (g/mol) 136.194
MDL Number MFCD00020050
SMILES CC1=CC(=C(C=C1C)O)C
Synonym pseudocumenol,phenol, 2,4,5-trimethyl,5-hydroxypseudocumene,1-hydroxy-2,4,5-trimethylbenzene,unii-3pca9e425c,acmc-1bmse,4-06-00-03247 beilstein handbook reference
IUPAC Name 2,4,5-trimethylphenol
InChI Key VXSCPERJHPWROZ-UHFFFAOYSA-N
Molecular Formula C9H12O
2,634

4-Dimethylaminobenzoic acid, 98%

CAS: 619-84-1 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.19 MDL Number: MFCD00002537 InChI Key: YDIYEOMDOWUDTJ-UHFFFAOYSA-N Synonym: 4-dimethylamino benzoic acid,benzoic acid, 4-dimethylamino,benzoic acid, p-dimethylamino,p-dimethylaminobenzoic acid,n,n-dimethyl-p-aminobenzoic acid,n,n-dimethyl-4-aminobenzoic acid,p-n,n-dimethylamino benzoic acid,p-dimethylamino benzoic acid,unii-d1ma908ev0,4-n,n-dimethylamino benzoic acid PubChem CID: 12092 IUPAC Name: 4-(dimethylamino)benzoic acid SMILES: CN(C)C1=CC=C(C=C1)C(=O)O

PubChem CID 12092
CAS 619-84-1
Molecular Weight (g/mol) 165.19
MDL Number MFCD00002537
SMILES CN(C)C1=CC=C(C=C1)C(=O)O
Synonym 4-dimethylamino benzoic acid,benzoic acid, 4-dimethylamino,benzoic acid, p-dimethylamino,p-dimethylaminobenzoic acid,n,n-dimethyl-p-aminobenzoic acid,n,n-dimethyl-4-aminobenzoic acid,p-n,n-dimethylamino benzoic acid,p-dimethylamino benzoic acid,unii-d1ma908ev0,4-n,n-dimethylamino benzoic acid
IUPAC Name 4-(dimethylamino)benzoic acid
InChI Key YDIYEOMDOWUDTJ-UHFFFAOYSA-N
Molecular Formula C9H11NO2
2,635

3-Amino-4-chlorobenzoic acid, 98%, Thermo Scientific™

CAS: 2840-28-0 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00007671 InChI Key: DMGFVJVLVZOSOE-UHFFFAOYSA-N Synonym: benzoic acid, 3-amino-4-chloro,unii-3q8r4430cf,3-amino-4-chloro benzoic acid,3-amino-4-chloro-benzoic acid,4-chloro-3-amino benzoic acid,pubchem8988,acmc-1cmgg,5-carboxy-2-chloroaniline,dsstox_cid_24414,dsstox_rid_80213 PubChem CID: 76092 IUPAC Name: 3-amino-4-chlorobenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)N)Cl

PubChem CID 76092
CAS 2840-28-0
Molecular Weight (g/mol) 171.58
MDL Number MFCD00007671
SMILES C1=CC(=C(C=C1C(=O)O)N)Cl
Synonym benzoic acid, 3-amino-4-chloro,unii-3q8r4430cf,3-amino-4-chloro benzoic acid,3-amino-4-chloro-benzoic acid,4-chloro-3-amino benzoic acid,pubchem8988,acmc-1cmgg,5-carboxy-2-chloroaniline,dsstox_cid_24414,dsstox_rid_80213
IUPAC Name 3-amino-4-chlorobenzoic acid
InChI Key DMGFVJVLVZOSOE-UHFFFAOYSA-N
Molecular Formula C7H6ClNO2
2,636

2-Amino-5-methylbenzoic acid, 97%

CAS: 2941-78-8 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00007909 InChI Key: NBUUUJWWOARGNW-UHFFFAOYSA-N Synonym: 5-methylanthranilic acid,6-amino-m-toluic acid,2-amino-5-methyl-benzoic acid,benzoic acid, 2-amino-5-methyl,m-toluic acid, 6-amino,2-amino-5-methylbenzoicacid,unii-418xaj22v2,2-amino-5-methyl benzoic acid,amino 2--5-methylbenzoic acid,pubchem4954 PubChem CID: 76255 IUPAC Name: 2-amino-5-methylbenzoic acid SMILES: CC1=CC=C(N)C(=C1)C(O)=O

PubChem CID 76255
CAS 2941-78-8
Molecular Weight (g/mol) 151.17
MDL Number MFCD00007909
SMILES CC1=CC=C(N)C(=C1)C(O)=O
Synonym 5-methylanthranilic acid,6-amino-m-toluic acid,2-amino-5-methyl-benzoic acid,benzoic acid, 2-amino-5-methyl,m-toluic acid, 6-amino,2-amino-5-methylbenzoicacid,unii-418xaj22v2,2-amino-5-methyl benzoic acid,amino 2--5-methylbenzoic acid,pubchem4954
IUPAC Name 2-amino-5-methylbenzoic acid
InChI Key NBUUUJWWOARGNW-UHFFFAOYSA-N
Molecular Formula C8H9NO2
2,637
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N-Methylanthranilic acid, 90+%

CAS: 119-68-6 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00002424 InChI Key: WVMBPWMAQDVZCM-UHFFFAOYSA-N Synonym: n-methylanthranilic acid,2-methylamino benzoic acid,n-methyl-2-aminobenzoic acid,n-methyl-o-aminobenzoic acid,benzoic acid, 2-methylamino,o-methylamino benzoic acid,anthranilic acid, n-methyl,2-methylamino-benzoic acid,kyselina n-methylanthranilova,unii-vpb2514iuj PubChem CID: 67069 ChEBI: CHEBI:16394 IUPAC Name: 2-(methylamino)benzoic acid SMILES: CNC1=CC=CC=C1C(=O)O

PubChem CID 67069
CAS 119-68-6
Molecular Weight (g/mol) 151.165
ChEBI CHEBI:16394
MDL Number MFCD00002424
SMILES CNC1=CC=CC=C1C(=O)O
Synonym n-methylanthranilic acid,2-methylamino benzoic acid,n-methyl-2-aminobenzoic acid,n-methyl-o-aminobenzoic acid,benzoic acid, 2-methylamino,o-methylamino benzoic acid,anthranilic acid, n-methyl,2-methylamino-benzoic acid,kyselina n-methylanthranilova,unii-vpb2514iuj
IUPAC Name 2-(methylamino)benzoic acid
InChI Key WVMBPWMAQDVZCM-UHFFFAOYSA-N
Molecular Formula C8H9NO2
2,638

2-Amino-3-methylbenzoic acid, 98%, Thermo Scientific Chemicals

CAS: 4389-45-1 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.16 MDL Number: MFCD00007745 InChI Key: WNAJXPYVTFYEST-UHFFFAOYSA-N Synonym: 3-methylanthranilic acid,2-amino-3-methyl-benzoic acid,2-amino-3-methylbenzoicacid,3-methyl-2-aminobenzoic acid,benzoic acid, 2-amino-3-methyl,2-amino-m-toluic acid,2-amino-3-methyl benzoic acid,m-toluic acid, 2-amino,unii-8rgx6sqe9n,2-amino-3-methylbenzoate PubChem CID: 78101 ChEBI: CHEBI:80574 IUPAC Name: 2-amino-3-methylbenzoic acid SMILES: CC1=CC=CC(=C1N)C(=O)O

PubChem CID 78101
CAS 4389-45-1
Molecular Weight (g/mol) 151.16
ChEBI CHEBI:80574
MDL Number MFCD00007745
SMILES CC1=CC=CC(=C1N)C(=O)O
Synonym 3-methylanthranilic acid,2-amino-3-methyl-benzoic acid,2-amino-3-methylbenzoicacid,3-methyl-2-aminobenzoic acid,benzoic acid, 2-amino-3-methyl,2-amino-m-toluic acid,2-amino-3-methyl benzoic acid,m-toluic acid, 2-amino,unii-8rgx6sqe9n,2-amino-3-methylbenzoate
IUPAC Name 2-amino-3-methylbenzoic acid
InChI Key WNAJXPYVTFYEST-UHFFFAOYSA-N
Molecular Formula C8H9NO2
2,639
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3-Aminophthalic acid hydrochloride dihydrate, 96%

CAS: 1852533-96-0 Molecular Formula: C8H8ClNO4 Molecular Weight (g/mol): 217.605 MDL Number: MFCD00150282 InChI Key: ZBZAVEORKXFUQB-UHFFFAOYSA-N Synonym: 3-aminophthalic acid hydrochloride,1,2-benzenedicarboxylic acid, 3-amino-, hydrochloride,1,2-benzenedicarboxylic acid, 3-amino-, hydrochloride 1:1,phthalic acid, hydrochloride,1, 3-amino-, hydrochloride,3-aminobenzene-1,2-dicarboxylic acid hydrochloride,3-amino phthalic acid hydrochloride,phthalic acid, 3-amino-, hydrochloride,acmc-1b7k3,ghl.pd_mitscher_leg0.1315 PubChem CID: 81375 IUPAC Name: 3-aminophthalic acid;hydrochloride SMILES: C1=CC(=C(C(=C1)N)C(=O)O)C(=O)O.Cl

PubChem CID 81375
CAS 1852533-96-0
Molecular Weight (g/mol) 217.605
MDL Number MFCD00150282
SMILES C1=CC(=C(C(=C1)N)C(=O)O)C(=O)O.Cl
Synonym 3-aminophthalic acid hydrochloride,1,2-benzenedicarboxylic acid, 3-amino-, hydrochloride,1,2-benzenedicarboxylic acid, 3-amino-, hydrochloride 1:1,phthalic acid, hydrochloride,1, 3-amino-, hydrochloride,3-aminobenzene-1,2-dicarboxylic acid hydrochloride,3-amino phthalic acid hydrochloride,phthalic acid, 3-amino-, hydrochloride,acmc-1b7k3,ghl.pd_mitscher_leg0.1315
IUPAC Name 3-aminophthalic acid;hydrochloride
InChI Key ZBZAVEORKXFUQB-UHFFFAOYSA-N
Molecular Formula C8H8ClNO4
2,640
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4-Aminophthalic acid, 98%

CAS: 5434-21-9 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00013985 InChI Key: OXSANYRLJHSQEP-UHFFFAOYSA-N Synonym: 4-aminobenzene-1,2-dicarboxylic acid,1,2-benzenedicarboxylic acid, 4-amino,4-amino-1,2-benzenedicarboxylic acid,4-amino phthalic acid,contains 3-aminophthalic acid,pubchem16853,acmc-1arqu,4-aminophthalic acid,ksc270i4n,ghl.pd_mitscher_leg0.1208 PubChem CID: 72912 IUPAC Name: 4-aminophthalic acid SMILES: C1=CC(=C(C=C1N)C(=O)O)C(=O)O

PubChem CID 72912
CAS 5434-21-9
Molecular Weight (g/mol) 181.147
MDL Number MFCD00013985
SMILES C1=CC(=C(C=C1N)C(=O)O)C(=O)O
Synonym 4-aminobenzene-1,2-dicarboxylic acid,1,2-benzenedicarboxylic acid, 4-amino,4-amino-1,2-benzenedicarboxylic acid,4-amino phthalic acid,contains 3-aminophthalic acid,pubchem16853,acmc-1arqu,4-aminophthalic acid,ksc270i4n,ghl.pd_mitscher_leg0.1208
IUPAC Name 4-aminophthalic acid
InChI Key OXSANYRLJHSQEP-UHFFFAOYSA-N
Molecular Formula C8H7NO4