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Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.
Hydroxybenzoic Acid Derivatives (18,478)
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1,756 – 1,770 of 64,662 results
1,756

Chlorcyclizine HCl, MP Biomedicals

CAS: 14362-31-3 Molecular Formula: C18H22Cl2N2 Molecular Weight (g/mol): 337.29 MDL Number: MFCD00035329 InChI Key: MSIJLVMSKDXAQN-UHFFFAOYNA-N Synonym: chlorcyclizine hydrochloride,chlorcyclizine hcl,histantin,eramide,perazil,di-paralene,chlorcyclizinium chloride,chlorcyclizine chloride,chlorcyclizine monohydrochloride,1-p-chlorobenzhydryl-4-methylpiperazine monohydrochloride PubChem CID: 62413 IUPAC Name: hydrogen 1-[(4-chlorophenyl)(phenyl)methyl]-4-methylpiperazine chloride SMILES: [H+].[Cl-].CN1CCN(CC1)C(C1=CC=CC=C1)C1=CC=C(Cl)C=C1

PubChem CID 62413
CAS 14362-31-3
Molecular Weight (g/mol) 337.29
MDL Number MFCD00035329
SMILES [H+].[Cl-].CN1CCN(CC1)C(C1=CC=CC=C1)C1=CC=C(Cl)C=C1
Synonym chlorcyclizine hydrochloride,chlorcyclizine hcl,histantin,eramide,perazil,di-paralene,chlorcyclizinium chloride,chlorcyclizine chloride,chlorcyclizine monohydrochloride,1-p-chlorobenzhydryl-4-methylpiperazine monohydrochloride
IUPAC Name hydrogen 1-[(4-chlorophenyl)(phenyl)methyl]-4-methylpiperazine chloride
InChI Key MSIJLVMSKDXAQN-UHFFFAOYNA-N
Molecular Formula C18H22Cl2N2
1,757

Manidipine dihydrochloride

CAS: 89226-75-5 Molecular Formula: C35H40Cl2N4O6 Molecular Weight (g/mol): 683.627 MDL Number: MFCD00896434 InChI Key: JINNGBXKBDUGQT-UHFFFAOYSA-N Synonym: manidipine hydrochloride PubChem CID: 150762 IUPAC Name: 5-O-[2-(4-benzhydrylpiperazin-1-yl)ethyl] 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate;dihydrochloride SMILES: CC1=C(C(C(=C(N1)C)C(=O)OCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)OC.Cl.Cl

PubChem CID 150762
CAS 89226-75-5
Molecular Weight (g/mol) 683.627
MDL Number MFCD00896434
SMILES CC1=C(C(C(=C(N1)C)C(=O)OCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)OC.Cl.Cl
Synonym manidipine hydrochloride
IUPAC Name 5-O-[2-(4-benzhydrylpiperazin-1-yl)ethyl] 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate;dihydrochloride
InChI Key JINNGBXKBDUGQT-UHFFFAOYSA-N
Molecular Formula C35H40Cl2N4O6
1,758

Thermo Scientific Chemicals alpha,alpha-Diphenylglycine, 98%

CAS: 3060-50-2 Molecular Formula: C14H13NO2 Molecular Weight (g/mol): 227.26 MDL Number: MFCD00008048 InChI Key: YBONNYNNFBAKLI-UHFFFAOYSA-N Synonym: 2,2-diphenylglycine,alpha,alpha-diphenylglycine,alpha-aminodiphenylacetic acid,glycine, 2,2-diphenyl,alpha-amino-alpha-phenylbenzeneacetic acid,.alpha.-aminodiphenylacetic acid,.alpha.,.alpha.-diphenylglycine,benzeneacetic acid, .alpha.-amino-.alpha.-phenyl,aminodiphenylacetic acid,phenytoin impurity c PubChem CID: 18289 IUPAC Name: 2-amino-2,2-diphenylacetic acid SMILES: NC(C(O)=O)(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 18289
CAS 3060-50-2
Molecular Weight (g/mol) 227.26
MDL Number MFCD00008048
SMILES NC(C(O)=O)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym 2,2-diphenylglycine,alpha,alpha-diphenylglycine,alpha-aminodiphenylacetic acid,glycine, 2,2-diphenyl,alpha-amino-alpha-phenylbenzeneacetic acid,.alpha.-aminodiphenylacetic acid,.alpha.,.alpha.-diphenylglycine,benzeneacetic acid, .alpha.-amino-.alpha.-phenyl,aminodiphenylacetic acid,phenytoin impurity c
IUPAC Name 2-amino-2,2-diphenylacetic acid
InChI Key YBONNYNNFBAKLI-UHFFFAOYSA-N
Molecular Formula C14H13NO2
1,759
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Octocrylene, 95%, Spectrum™ Chemical
SDP

CAS: 6197-30-4 Molecular Formula: C24H27NO2 Molecular Weight (g/mol): 361.49 MDL Number: MFCD00059260 InChI Key: FMJSMJQBSVNSBF-UHFFFAOYNA-N IUPAC Name: 2-ethylhexyl 2-cyano-3,3-diphenylprop-2-enoate SMILES: CCCCC(CC)COC(=O)C(C#N)=C(C1=CC=CC=C1)C1=CC=CC=C1

CAS 6197-30-4
Molecular Weight (g/mol) 361.49
MDL Number MFCD00059260
SMILES CCCCC(CC)COC(=O)C(C#N)=C(C1=CC=CC=C1)C1=CC=CC=C1
IUPAC Name 2-ethylhexyl 2-cyano-3,3-diphenylprop-2-enoate
InChI Key FMJSMJQBSVNSBF-UHFFFAOYNA-N
Molecular Formula C24H27NO2
1,760

Methyl 2-aminopyridine-4-carboxylate, 98%

CAS: 6937-03-7 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD04039316 InChI Key: SVWWNEYBEFASMP-UHFFFAOYSA-N IUPAC Name: methyl 2-aminopyridine-4-carboxylate

CAS 6937-03-7
Molecular Weight (g/mol) 152.15
MDL Number MFCD04039316
IUPAC Name methyl 2-aminopyridine-4-carboxylate
InChI Key SVWWNEYBEFASMP-UHFFFAOYSA-N
Molecular Formula C7H8N2O2
1,761

4-Aminobenzoic acid sodium salt, 98%

CAS: 555-06-6 Molecular Formula: C7H6NNaO2 Molecular Weight (g/mol): 159.12 MDL Number: MFCD00064395 InChI Key: XETSAYZRDCRPJY-UHFFFAOYSA-M Synonym: sodium 4-aminobenzoate,sodium p-aminobenzoate,4-aminobenzoic acid sodium salt,sodium aminobenzoate,aminobenzoate sodium,antergyl,pabavit,benzoic acid, 4-amino-, monosodium salt,monosodium 4-aminobenzoate,unii-75ui7quz5j PubChem CID: 517441 IUPAC Name: sodium;4-aminobenzoate SMILES: C1=CC(=CC=C1C(=O)[O-])N.[Na+]

PubChem CID 517441
CAS 555-06-6
Molecular Weight (g/mol) 159.12
MDL Number MFCD00064395
SMILES C1=CC(=CC=C1C(=O)[O-])N.[Na+]
Synonym sodium 4-aminobenzoate,sodium p-aminobenzoate,4-aminobenzoic acid sodium salt,sodium aminobenzoate,aminobenzoate sodium,antergyl,pabavit,benzoic acid, 4-amino-, monosodium salt,monosodium 4-aminobenzoate,unii-75ui7quz5j
IUPAC Name sodium;4-aminobenzoate
InChI Key XETSAYZRDCRPJY-UHFFFAOYSA-M
Molecular Formula C7H6NNaO2
1,762

4-Amino-3-(trifluoromethoxy)benzoic acid, 95%, Thermo Scientific™

CAS: 175278-22-5 Molecular Formula: C8H6F3NO3 Molecular Weight (g/mol): 221.135 InChI Key: IXJFWBNYFTWBOR-UHFFFAOYSA-N Synonym: 4-amino-3-trifluoromethoxy benzoic acid,rarechem al bo 0798,buttpark 83\07-32,4-amino-3-trifluoromethoxy-benzoic acid,4-amine-3-trifluoromethoxy benzoic acid,benzoic acid, 4-amino-3-trifluoromethoxy,4-amino-3-trifluoromethoxybenzoicacid,pubchem14042,acmc-209e9s PubChem CID: 2735951 IUPAC Name: 4-amino-3-(trifluoromethoxy)benzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)OC(F)(F)F)N

PubChem CID 2735951
CAS 175278-22-5
Molecular Weight (g/mol) 221.135
SMILES C1=CC(=C(C=C1C(=O)O)OC(F)(F)F)N
Synonym 4-amino-3-trifluoromethoxy benzoic acid,rarechem al bo 0798,buttpark 83\07-32,4-amino-3-trifluoromethoxy-benzoic acid,4-amine-3-trifluoromethoxy benzoic acid,benzoic acid, 4-amino-3-trifluoromethoxy,4-amino-3-trifluoromethoxybenzoicacid,pubchem14042,acmc-209e9s
IUPAC Name 4-amino-3-(trifluoromethoxy)benzoic acid
InChI Key IXJFWBNYFTWBOR-UHFFFAOYSA-N
Molecular Formula C8H6F3NO3
1,763

2-Amino-4-fluorobenzoic acid, 96%

CAS: 446-32-2 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.13 MDL Number: MFCD00075553 InChI Key: LGPVTNAJFDUWLF-UHFFFAOYSA-N Synonym: 4-fluoroanthranilic acid,2-amino-4-fluoro-benzoic acid,benzoic acid, 2-amino-4-fluoro,2-amino-4-fluoro benzoic acid,2-amino-4-fluorobenzoicacid,fa0,pubchem1323,amino-4-fluorobenzoic acid,acmc-209jz7,2-amino-4fluorobenzoic acid PubChem CID: 2724967 IUPAC Name: 2-amino-4-fluorobenzoic acid SMILES: C1=CC(=C(C=C1F)N)C(=O)O

PubChem CID 2724967
CAS 446-32-2
Molecular Weight (g/mol) 155.13
MDL Number MFCD00075553
SMILES C1=CC(=C(C=C1F)N)C(=O)O
Synonym 4-fluoroanthranilic acid,2-amino-4-fluoro-benzoic acid,benzoic acid, 2-amino-4-fluoro,2-amino-4-fluoro benzoic acid,2-amino-4-fluorobenzoicacid,fa0,pubchem1323,amino-4-fluorobenzoic acid,acmc-209jz7,2-amino-4fluorobenzoic acid
IUPAC Name 2-amino-4-fluorobenzoic acid
InChI Key LGPVTNAJFDUWLF-UHFFFAOYSA-N
Molecular Formula C7H6FNO2
1,764

3-(4-Methylpiperazin-1-yl)benzoic acid, ≥97%, Thermo Scientific™

CAS: 215309-01-6 Molecular Formula: C12H16N2O2 Molecular Weight (g/mol): 220.27 MDL Number: MFCD06742238 InChI Key: HALATUFUWLWCQV-UHFFFAOYSA-N Synonym: 3-4-methylpiperazin-1-yl benzoic acid,3-4-methylpiperazin-1-yl benzoicacid,benzoicacid, 3-4-methyl-1-piperazinyl,zlchem 853,pubchem12997,acmc-209fli,r-1-fmoc-3-hydroxypyrrolidine,3-4-methylpiperazinyl benzoic acid,3-4-methylpiperazinyl-benzoic acid,3-4-methyl-1-piperazinyl benzoic acid PubChem CID: 4741681 IUPAC Name: 3-(4-methylpiperazin-1-yl)benzoic acid SMILES: CN1CCN(CC1)C1=CC=CC(=C1)C(O)=O

PubChem CID 4741681
CAS 215309-01-6
Molecular Weight (g/mol) 220.27
MDL Number MFCD06742238
SMILES CN1CCN(CC1)C1=CC=CC(=C1)C(O)=O
Synonym 3-4-methylpiperazin-1-yl benzoic acid,3-4-methylpiperazin-1-yl benzoicacid,benzoicacid, 3-4-methyl-1-piperazinyl,zlchem 853,pubchem12997,acmc-209fli,r-1-fmoc-3-hydroxypyrrolidine,3-4-methylpiperazinyl benzoic acid,3-4-methylpiperazinyl-benzoic acid,3-4-methyl-1-piperazinyl benzoic acid
IUPAC Name 3-(4-methylpiperazin-1-yl)benzoic acid
InChI Key HALATUFUWLWCQV-UHFFFAOYSA-N
Molecular Formula C12H16N2O2
1,765

4-Amino-2-chlorobenzoic acid, 97%

CAS: 2457-76-3 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00007772 InChI Key: MBDUKNCPOPMRJQ-UHFFFAOYSA-N Synonym: 2-chloro-4-aminobenzoic acid,benzoic acid, 4-amino-2-chloro,o-chloro-p-aminobenzoic acid,2-chloro-p-aminobenzoic acid,usaf nb-1,4-amino-2-chloro-benzoic acid,4-amino-2-chlorobenzoicacid,unii-y3s6924ia6,wln: zr cg dvq,pubchem3109 PubChem CID: 17154 ChEBI: CHEBI:59472 IUPAC Name: 4-amino-2-chlorobenzoic acid SMILES: C1=CC(=C(C=C1N)Cl)C(=O)O

PubChem CID 17154
CAS 2457-76-3
Molecular Weight (g/mol) 171.58
ChEBI CHEBI:59472
MDL Number MFCD00007772
SMILES C1=CC(=C(C=C1N)Cl)C(=O)O
Synonym 2-chloro-4-aminobenzoic acid,benzoic acid, 4-amino-2-chloro,o-chloro-p-aminobenzoic acid,2-chloro-p-aminobenzoic acid,usaf nb-1,4-amino-2-chloro-benzoic acid,4-amino-2-chlorobenzoicacid,unii-y3s6924ia6,wln: zr cg dvq,pubchem3109
IUPAC Name 4-amino-2-chlorobenzoic acid
InChI Key MBDUKNCPOPMRJQ-UHFFFAOYSA-N
Molecular Formula C7H6ClNO2
1,766
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Flufenamic Acid, Spectrum™ Chemical
SDP

CAS: 530-78-9

CAS 530-78-9
1,767
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Methyl 3-iodo-4-methoxybenzoate, 98%

CAS: 35387-93-0 Molecular Formula: C9H9IO3 Molecular Weight (g/mol): 292.07 MDL Number: MFCD00052925 InChI Key: GHNGBFHLUOJHKP-UHFFFAOYSA-N Synonym: 3-iodo-4-methoxy-benzoic acid methyl ester,3-iodo-4-methoxybenzoic acid methyl ester,benzoic acid, 3-iodo-4-methoxy-, methyl ester,methyl3-iodo-4-methoxybenzoate,methyl 3-iodo-p-anisate,acmc-1agb4,ksc495q3h,methyl-3-iodo-4-methoxybenzoate,methyl 3-iodo-4-methoxy-benzoate,3-iodo-p-anisic acid methyl ester PubChem CID: 316980 IUPAC Name: methyl 3-iodo-4-methoxybenzoate SMILES: COC(=O)C1=CC=C(OC)C(I)=C1

PubChem CID 316980
CAS 35387-93-0
Molecular Weight (g/mol) 292.07
MDL Number MFCD00052925
SMILES COC(=O)C1=CC=C(OC)C(I)=C1
Synonym 3-iodo-4-methoxy-benzoic acid methyl ester,3-iodo-4-methoxybenzoic acid methyl ester,benzoic acid, 3-iodo-4-methoxy-, methyl ester,methyl3-iodo-4-methoxybenzoate,methyl 3-iodo-p-anisate,acmc-1agb4,ksc495q3h,methyl-3-iodo-4-methoxybenzoate,methyl 3-iodo-4-methoxy-benzoate,3-iodo-p-anisic acid methyl ester
IUPAC Name methyl 3-iodo-4-methoxybenzoate
InChI Key GHNGBFHLUOJHKP-UHFFFAOYSA-N
Molecular Formula C9H9IO3
1,768
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6-Fluorosalicylic acid, 98+%, Thermo Scientific™

CAS: 67531-86-6 Molecular Formula: C7H5FO3 Molecular Weight (g/mol): 156.11 InChI Key: BCEKGWWLVKXZKK-UHFFFAOYSA-N Synonym: 6-fluorosalicylic acid,6-fluoro-2-hydroxybenzoic acid,2-fluoro-6-hydroxybenzoicacid,6-fluorosalicylicacid,benzoic acid, 2-fluoro-6-hydroxy,2-fluoro-6-hydoxybenzoic acid,pubchem4958,acmc-1baav,2-carboxy-3-fluorophenol PubChem CID: 586777 IUPAC Name: 2-fluoro-6-hydroxybenzoic acid SMILES: C1=CC(=C(C(=C1)F)C(=O)O)O

PubChem CID 586777
CAS 67531-86-6
Molecular Weight (g/mol) 156.11
SMILES C1=CC(=C(C(=C1)F)C(=O)O)O
Synonym 6-fluorosalicylic acid,6-fluoro-2-hydroxybenzoic acid,2-fluoro-6-hydroxybenzoicacid,6-fluorosalicylicacid,benzoic acid, 2-fluoro-6-hydroxy,2-fluoro-6-hydoxybenzoic acid,pubchem4958,acmc-1baav,2-carboxy-3-fluorophenol
IUPAC Name 2-fluoro-6-hydroxybenzoic acid
InChI Key BCEKGWWLVKXZKK-UHFFFAOYSA-N
Molecular Formula C7H5FO3
1,769
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p-Anisidine hydrochloride, 99%

CAS: 20265-97-8 Molecular Formula: C7H9NO·HCl Molecular Weight (g/mol): 159.61 MDL Number: MFCD00036388 InChI Key: VQYJLACQFYZHCO-UHFFFAOYSA-N Synonym: p-anisidine hydrochloride,4-methoxyaniline hydrochloride,unii-7c4r75n8vg,benzenamine, 4-methoxy-, hydrochloride,p-anisidine.hcl,p-anisidine hcl,p-anisidinium chloride,4-anisidine hydrochloride,p-anisylamine hydrochloride,p-aminoanisole hydrochloride PubChem CID: 2734956 IUPAC Name: 4-methoxyaniline;hydrochloride SMILES: COC1=CC=C(C=C1)N.Cl

PubChem CID 2734956
CAS 20265-97-8
Molecular Weight (g/mol) 159.61
MDL Number MFCD00036388
SMILES COC1=CC=C(C=C1)N.Cl
Synonym p-anisidine hydrochloride,4-methoxyaniline hydrochloride,unii-7c4r75n8vg,benzenamine, 4-methoxy-, hydrochloride,p-anisidine.hcl,p-anisidine hcl,p-anisidinium chloride,4-anisidine hydrochloride,p-anisylamine hydrochloride,p-aminoanisole hydrochloride
IUPAC Name 4-methoxyaniline;hydrochloride
InChI Key VQYJLACQFYZHCO-UHFFFAOYSA-N
Molecular Formula C7H9NO·HCl
1,770
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4-bromo-1-fluoro-2-nitrobenzene, 98%

CAS: 364-73-8 Molecular Formula: C6H3BrFNO2 Molecular Weight (g/mol): 220.00 MDL Number: MFCD00129165 InChI Key: UQEANKGXXSENNF-UHFFFAOYSA-N Synonym: 5-bromo-2-fluoronitrobenzene,1-bromo-4-fluoro-3-nitrobenzene,2-fluoro-5-bromonitrobenzene,4-bromo-1-fluoro-2-nitro-benzene,benzene, 4-bromo-1-fluoro-2-nitro,pubchem1046,5-bromo-fluoronitrobenzene,acmc-1cpc6,5-bromo-2-fluronitrobenzene,ksc226i7f PubChem CID: 2736328 IUPAC Name: 4-bromo-1-fluoro-2-nitrobenzene SMILES: [O-][N+](=O)C1=CC(Br)=CC=C1F

PubChem CID 2736328
CAS 364-73-8
Molecular Weight (g/mol) 220.00
MDL Number MFCD00129165
SMILES [O-][N+](=O)C1=CC(Br)=CC=C1F
Synonym 5-bromo-2-fluoronitrobenzene,1-bromo-4-fluoro-3-nitrobenzene,2-fluoro-5-bromonitrobenzene,4-bromo-1-fluoro-2-nitro-benzene,benzene, 4-bromo-1-fluoro-2-nitro,pubchem1046,5-bromo-fluoronitrobenzene,acmc-1cpc6,5-bromo-2-fluronitrobenzene,ksc226i7f
IUPAC Name 4-bromo-1-fluoro-2-nitrobenzene
InChI Key UQEANKGXXSENNF-UHFFFAOYSA-N
Molecular Formula C6H3BrFNO2