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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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3,571 – 3,585 of 159,106 results
3,571
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4'-Nitroacetanilide, 99%

CAS: 104-04-1 Molecular Formula: C8H8N2O3 Molecular Weight (g/mol): 180.16 MDL Number: MFCD00007303 InChI Key: NQRLPDFELNCFHW-UHFFFAOYSA-N Synonym: 4'-nitroacetanilide,n-4-nitrophenyl acetamide,4-nitroacetanilide,p-nitroacetanilide,acetamide, n-4-nitrophenyl,n-acetyl-4-nitroaniline,p-acetamidonitrobenzene,acetanilide, p-nitro,p-nitrophenylacetanilide,n-acetyl-p-nitroaniline PubChem CID: 7691 IUPAC Name: N-(4-nitrophenyl)acetamide SMILES: CC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]

PubChem CID 7691
CAS 104-04-1
Molecular Weight (g/mol) 180.16
MDL Number MFCD00007303
SMILES CC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]
Synonym 4'-nitroacetanilide,n-4-nitrophenyl acetamide,4-nitroacetanilide,p-nitroacetanilide,acetamide, n-4-nitrophenyl,n-acetyl-4-nitroaniline,p-acetamidonitrobenzene,acetanilide, p-nitro,p-nitrophenylacetanilide,n-acetyl-p-nitroaniline
IUPAC Name N-(4-nitrophenyl)acetamide
InChI Key NQRLPDFELNCFHW-UHFFFAOYSA-N
Molecular Formula C8H8N2O3
3,572
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2-Iodobenzoic acid, 98+%

CAS: 88-67-5 Molecular Formula: C7H5IO2 Molecular Weight (g/mol): 248.019 MDL Number: MFCD00002419 InChI Key: CJNZAXGUTKBIHP-UHFFFAOYSA-N Synonym: o-iodobenzoic acid,benzoic acid, 2-iodo,iodobenzoic acid,benzoic acid, o-iodo,usaf ek-572,2-iodo benzoic acid,2-iodo-benzoic acid,benzoic acid, iodo,kyselina o-jodbenzoova,o-jod-benzoesaeure PubChem CID: 6941 ChEBI: CHEBI:287979 IUPAC Name: 2-iodobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)I

PubChem CID 6941
CAS 88-67-5
Molecular Weight (g/mol) 248.019
ChEBI CHEBI:287979
MDL Number MFCD00002419
SMILES C1=CC=C(C(=C1)C(=O)O)I
Synonym o-iodobenzoic acid,benzoic acid, 2-iodo,iodobenzoic acid,benzoic acid, o-iodo,usaf ek-572,2-iodo benzoic acid,2-iodo-benzoic acid,benzoic acid, iodo,kyselina o-jodbenzoova,o-jod-benzoesaeure
IUPAC Name 2-iodobenzoic acid
InChI Key CJNZAXGUTKBIHP-UHFFFAOYSA-N
Molecular Formula C7H5IO2
3,573
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Methyl 4-fluorobenzoate, 98%

CAS: 403-33-8 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 InChI Key: MSEBQGULDWDIRW-UHFFFAOYSA-N Synonym: methyl p-fluorobenzoate,4-fluorobenzoic acid methyl ester,methyl 4-fluorobenzoic acid,benzoic acid, 4-fluoro-, methyl ester,methyl4-fluorobenzoate,methyl-4-fluorobenzoate,4-fluoro-benzoic acid methyl ester,pubchem3566,acmc-1aef0,asischem p32019 PubChem CID: 67878 IUPAC Name: methyl 4-fluorobenzoate SMILES: COC(=O)C1=CC=C(C=C1)F

PubChem CID 67878
CAS 403-33-8
Molecular Weight (g/mol) 154.14
SMILES COC(=O)C1=CC=C(C=C1)F
Synonym methyl p-fluorobenzoate,4-fluorobenzoic acid methyl ester,methyl 4-fluorobenzoic acid,benzoic acid, 4-fluoro-, methyl ester,methyl4-fluorobenzoate,methyl-4-fluorobenzoate,4-fluoro-benzoic acid methyl ester,pubchem3566,acmc-1aef0,asischem p32019
IUPAC Name methyl 4-fluorobenzoate
InChI Key MSEBQGULDWDIRW-UHFFFAOYSA-N
Molecular Formula C8H7FO2
3,574
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5-Fluoro-2-methylbenzoyl chloride, 98%

CAS: 21900-39-0 Molecular Formula: C8H6ClFO Molecular Weight (g/mol): 172.58 MDL Number: MFCD00236681 InChI Key: HBAQRSDZSVESSF-UHFFFAOYSA-N Synonym: 5-fluoro-2-methylbenzoylchloride,5-fluoro-2-methyl-benzoyl chloride,benzoyl chloride,5-fluoro-2-methyl,acmc-1ciaq,2-methyl-5-fluorobenzoyl chloride,5-fluoro-2-methyl benzoylchloride,5-fluoro-2-methyl benzoyl chloride,benzoyl chloride, 5-fluoro-2-methyl,5-fluoro-2-methylbenzoyl chloride PubChem CID: 2737383 IUPAC Name: 5-fluoro-2-methylbenzoyl chloride SMILES: CC1=CC=C(F)C=C1C(Cl)=O

PubChem CID 2737383
CAS 21900-39-0
Molecular Weight (g/mol) 172.58
MDL Number MFCD00236681
SMILES CC1=CC=C(F)C=C1C(Cl)=O
Synonym 5-fluoro-2-methylbenzoylchloride,5-fluoro-2-methyl-benzoyl chloride,benzoyl chloride,5-fluoro-2-methyl,acmc-1ciaq,2-methyl-5-fluorobenzoyl chloride,5-fluoro-2-methyl benzoylchloride,5-fluoro-2-methyl benzoyl chloride,benzoyl chloride, 5-fluoro-2-methyl,5-fluoro-2-methylbenzoyl chloride
IUPAC Name 5-fluoro-2-methylbenzoyl chloride
InChI Key HBAQRSDZSVESSF-UHFFFAOYSA-N
Molecular Formula C8H6ClFO
3,575
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Methyl 2-amino-4-chlorobenzoate, 98%

CAS: 5900-58-3 Molecular Formula: C8H8ClNO2 Molecular Weight (g/mol): 185.607 MDL Number: MFCD00017568 InChI Key: YPSSCICDVDOEAI-UHFFFAOYSA-N Synonym: methyl 4-chloroanthranilate,2-amino-4-chloro-benzoic acid methyl ester,methyl2-amino-4-chlorobenzoate,benzoic acid, 2-amino-4-chloro-, methyl ester,2-amino-4-chlorobenzoic acid methyl ester,pubchem4643,methyl 4-chloro-anthranilate,methyl 2-amino4-chlorobenzoate,methyl-2-amino-4-chlorobenzoate PubChem CID: 80001 IUPAC Name: methyl 2-amino-4-chlorobenzoate SMILES: COC(=O)C1=C(C=C(C=C1)Cl)N

PubChem CID 80001
CAS 5900-58-3
Molecular Weight (g/mol) 185.607
MDL Number MFCD00017568
SMILES COC(=O)C1=C(C=C(C=C1)Cl)N
Synonym methyl 4-chloroanthranilate,2-amino-4-chloro-benzoic acid methyl ester,methyl2-amino-4-chlorobenzoate,benzoic acid, 2-amino-4-chloro-, methyl ester,2-amino-4-chlorobenzoic acid methyl ester,pubchem4643,methyl 4-chloro-anthranilate,methyl 2-amino4-chlorobenzoate,methyl-2-amino-4-chlorobenzoate
IUPAC Name methyl 2-amino-4-chlorobenzoate
InChI Key YPSSCICDVDOEAI-UHFFFAOYSA-N
Molecular Formula C8H8ClNO2
3,576
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3-Fluorophthalic acid, 97%

CAS: 1583-67-1 Molecular Formula: C8H5FO4 Molecular Weight (g/mol): 184.122 MDL Number: MFCD00039524 InChI Key: BBCQSMSCEJBIRD-UHFFFAOYSA-N Synonym: 3-fluorobenzene-1,2-dicarboxylic acid,3-fluoro-1,2-benzenedicarboxylic acid,1,2-benzenedicarboxylic acid, 3-fluoro,1,2-benzenedicarboxylic acid, fluoro,3-fluorophthalic,3-fluorophtalic acid,3-fluorophthatic acid,pubchem1405,3-fluorophthalicacid PubChem CID: 345381 IUPAC Name: 3-fluorophthalic acid SMILES: C1=CC(=C(C(=C1)F)C(=O)O)C(=O)O

PubChem CID 345381
CAS 1583-67-1
Molecular Weight (g/mol) 184.122
MDL Number MFCD00039524
SMILES C1=CC(=C(C(=C1)F)C(=O)O)C(=O)O
Synonym 3-fluorobenzene-1,2-dicarboxylic acid,3-fluoro-1,2-benzenedicarboxylic acid,1,2-benzenedicarboxylic acid, 3-fluoro,1,2-benzenedicarboxylic acid, fluoro,3-fluorophthalic,3-fluorophtalic acid,3-fluorophthatic acid,pubchem1405,3-fluorophthalicacid
IUPAC Name 3-fluorophthalic acid
InChI Key BBCQSMSCEJBIRD-UHFFFAOYSA-N
Molecular Formula C8H5FO4
3,577

3-Iodophthalic acid, ≥95%, Thermo Scientific™

CAS: 6937-34-4 Molecular Formula: C8H5IO4 Molecular Weight (g/mol): 292.03 MDL Number: MFCD00275568 InChI Key: HNPVERUJGFNNRV-UHFFFAOYSA-N Synonym: 3-iodobenzene-1,2-dicarboxylic acid,1,2-benzenedicarboxylicacid, 3-iodo,maybridge1_008994,3-iodo-phthalic acid,1,2-benzenedicarboxylic acid, 3-iodo PubChem CID: 238231 IUPAC Name: 3-iodophthalic acid SMILES: OC(=O)C1=CC=CC(I)=C1C(O)=O

PubChem CID 238231
CAS 6937-34-4
Molecular Weight (g/mol) 292.03
MDL Number MFCD00275568
SMILES OC(=O)C1=CC=CC(I)=C1C(O)=O
Synonym 3-iodobenzene-1,2-dicarboxylic acid,1,2-benzenedicarboxylicacid, 3-iodo,maybridge1_008994,3-iodo-phthalic acid,1,2-benzenedicarboxylic acid, 3-iodo
IUPAC Name 3-iodophthalic acid
InChI Key HNPVERUJGFNNRV-UHFFFAOYSA-N
Molecular Formula C8H5IO4
3,578
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Methyl 3-bromobenzoate, 98+%

CAS: 618-89-3 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00017777 InChI Key: KMFJVYMFCAIRAN-UHFFFAOYSA-N Synonym: methyl m-bromobenzoate,3-bromobenzoic acid methyl ester,benzoic acid, 3-bromo-, methyl ester,3-bromobenzoic acid, methyl ester,methyl-3-bromobenzoate,benzoic acid, m-bromo-, methyl ester,m-bromobenzoic acid methyl ester,pubchem3961,methyl m-bromo benzoate,methyl 3-bromo-benzoate PubChem CID: 12070 IUPAC Name: methyl 3-bromobenzoate SMILES: COC(=O)C1=CC(=CC=C1)Br

PubChem CID 12070
CAS 618-89-3
Molecular Weight (g/mol) 215.046
MDL Number MFCD00017777
SMILES COC(=O)C1=CC(=CC=C1)Br
Synonym methyl m-bromobenzoate,3-bromobenzoic acid methyl ester,benzoic acid, 3-bromo-, methyl ester,3-bromobenzoic acid, methyl ester,methyl-3-bromobenzoate,benzoic acid, m-bromo-, methyl ester,m-bromobenzoic acid methyl ester,pubchem3961,methyl m-bromo benzoate,methyl 3-bromo-benzoate
IUPAC Name methyl 3-bromobenzoate
InChI Key KMFJVYMFCAIRAN-UHFFFAOYSA-N
Molecular Formula C8H7BrO2
3,579
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2-Iodo-3-methylbenzoic acid, 98%

CAS: 108078-14-4 Molecular Formula: C8H7IO2 Molecular Weight (g/mol): 262.046 MDL Number: MFCD00079764 InChI Key: PZUXUOZSSYKAMX-UHFFFAOYSA-N Synonym: 2-iodo-m-toluic acid,benzoic acid,2-iodo-3-methyl,2-iodo-3-methyl-benzoic acid,pubchem12741,acmc-1bsuz,3-methyl-2-iodobenzoic acid,2-iodo-3-methyl benzoic acid,buttpark 148\07-11,2-iodo-3-methylbenzoic acid PubChem CID: 2759365 IUPAC Name: 2-iodo-3-methylbenzoic acid SMILES: CC1=CC=CC(=C1I)C(=O)O

PubChem CID 2759365
CAS 108078-14-4
Molecular Weight (g/mol) 262.046
MDL Number MFCD00079764
SMILES CC1=CC=CC(=C1I)C(=O)O
Synonym 2-iodo-m-toluic acid,benzoic acid,2-iodo-3-methyl,2-iodo-3-methyl-benzoic acid,pubchem12741,acmc-1bsuz,3-methyl-2-iodobenzoic acid,2-iodo-3-methyl benzoic acid,buttpark 148\07-11,2-iodo-3-methylbenzoic acid
IUPAC Name 2-iodo-3-methylbenzoic acid
InChI Key PZUXUOZSSYKAMX-UHFFFAOYSA-N
Molecular Formula C8H7IO2
3,580
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2,4-Difluorobenzoic acid, 98%

CAS: 1583-58-0 Molecular Formula: C7H4F2O2 Molecular Weight (g/mol): 158.10 MDL Number: MFCD00011670 InChI Key: NJYBIFYEWYWYAN-UHFFFAOYSA-N Synonym: 2,4-dfba,benzoic acid, 2,4-difluoro,2,4-difluorobenzoicacid,2,4-difluoro-benzoic acid,zlchem 472,pubchem1336,acmc-1brgf,2,4-difluorbenzoic acid,2,4-difluorobezoic acid,2 4-difluorobenzoic acid PubChem CID: 74102 IUPAC Name: 2,4-difluorobenzoic acid SMILES: OC(=O)C1=CC=C(F)C=C1F

PubChem CID 74102
CAS 1583-58-0
Molecular Weight (g/mol) 158.10
MDL Number MFCD00011670
SMILES OC(=O)C1=CC=C(F)C=C1F
Synonym 2,4-dfba,benzoic acid, 2,4-difluoro,2,4-difluorobenzoicacid,2,4-difluoro-benzoic acid,zlchem 472,pubchem1336,acmc-1brgf,2,4-difluorbenzoic acid,2,4-difluorobezoic acid,2 4-difluorobenzoic acid
IUPAC Name 2,4-difluorobenzoic acid
InChI Key NJYBIFYEWYWYAN-UHFFFAOYSA-N
Molecular Formula C7H4F2O2
3,581
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2-Chlorobenzoyl chloride, 97%

CAS: 609-65-4 Molecular Formula: C7H4Cl2O Molecular Weight (g/mol): 175.01 MDL Number: MFCD00000660 InChI Key: ONIKNECPXCLUHT-UHFFFAOYSA-N Synonym: benzoyl chloride, 2-chloro,o-chlorobenzoyl chloride,chlorobenzoyl chloride,benzoyl chloride, o-chloro,ococ,2-chloro-benzoyl chloride,unii-jr29a4n74x,o-chlorobenzoylchloride,2-chlorobenzoylchloride,2-chlorobenzoic acid chloride PubChem CID: 69110 ChEBI: CHEBI:60719 IUPAC Name: 2-chlorobenzoyl chloride SMILES: ClC(=O)C1=CC=CC=C1Cl

PubChem CID 69110
CAS 609-65-4
Molecular Weight (g/mol) 175.01
ChEBI CHEBI:60719
MDL Number MFCD00000660
SMILES ClC(=O)C1=CC=CC=C1Cl
Synonym benzoyl chloride, 2-chloro,o-chlorobenzoyl chloride,chlorobenzoyl chloride,benzoyl chloride, o-chloro,ococ,2-chloro-benzoyl chloride,unii-jr29a4n74x,o-chlorobenzoylchloride,2-chlorobenzoylchloride,2-chlorobenzoic acid chloride
IUPAC Name 2-chlorobenzoyl chloride
InChI Key ONIKNECPXCLUHT-UHFFFAOYSA-N
Molecular Formula C7H4Cl2O
3,582
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2-chloro-5-methylbenzoic acid, 98%

CAS: 6342-60-5 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 InChI Key: LEBWXJZAWTVKFL-UHFFFAOYSA-N Synonym: 2-chloro-5-methylbenzole acid,6-chloro-m-toluic acid,benzoic acid, 2-chloro-5-methyl,pubchem12501,3-carboxy-4-chlorotoluene,acmc-1b72o,ksc497q1d,2-chloro-5-methylbenozic acid,2-chloro-5-methyl-benzoic acid,lebwxjzawtvkfl-uhfffaoysa PubChem CID: 240430 IUPAC Name: 2-chloro-5-methylbenzoic acid SMILES: CC1=CC(=C(C=C1)Cl)C(=O)O

PubChem CID 240430
CAS 6342-60-5
Molecular Weight (g/mol) 170.59
SMILES CC1=CC(=C(C=C1)Cl)C(=O)O
Synonym 2-chloro-5-methylbenzole acid,6-chloro-m-toluic acid,benzoic acid, 2-chloro-5-methyl,pubchem12501,3-carboxy-4-chlorotoluene,acmc-1b72o,ksc497q1d,2-chloro-5-methylbenozic acid,2-chloro-5-methyl-benzoic acid,lebwxjzawtvkfl-uhfffaoysa
IUPAC Name 2-chloro-5-methylbenzoic acid
InChI Key LEBWXJZAWTVKFL-UHFFFAOYSA-N
Molecular Formula C8H7ClO2
3,583
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3-Carboxy-5-fluorobenzeneboronic acid pinacol ester, 96%, Thermo Scientific Chemicals

CAS: 936728-22-2 Molecular Formula: C13H16BFO4 Molecular Weight (g/mol): 266.075 MDL Number: MFCD12756465 InChI Key: NMYIHYHALOHVHV-UHFFFAOYSA-N Synonym: 3-fluoro-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzoic acid,3-carboxy-5-fluorophenylboronic acid, pinacol ester,3-carboxy-5-fluorobenzeneboronic acid pinacol ester,3-fluoro-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzoicacid,3-fluoro-5-tetramethyl-1,3,2-dioxaborolan-2-yl benzoic acid PubChem CID: 46739807 IUPAC Name: 3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)F)C(=O)O

PubChem CID 46739807
CAS 936728-22-2
Molecular Weight (g/mol) 266.075
MDL Number MFCD12756465
SMILES B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)F)C(=O)O
Synonym 3-fluoro-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzoic acid,3-carboxy-5-fluorophenylboronic acid, pinacol ester,3-carboxy-5-fluorobenzeneboronic acid pinacol ester,3-fluoro-5-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzoicacid,3-fluoro-5-tetramethyl-1,3,2-dioxaborolan-2-yl benzoic acid
IUPAC Name 3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
InChI Key NMYIHYHALOHVHV-UHFFFAOYSA-N
Molecular Formula C13H16BFO4
3,584
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6-Methoxysalicylic acid, 98%, Thermo Scientific™

CAS: 3147-64-6 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 InChI Key: AAUQLHHARJUJEH-UHFFFAOYSA-N Synonym: 6-methoxysalicylic acid,6-hydroxy-o-anisic acid,benzoic acid, 2-hydroxy-6-methoxy,6-methoxysalicylicacid,6-methoxysalicylsaure,pubchem18380,acmc-1cldg,6-methoxy-salicylic acid,2-carboxy-3-methoxyphenol,2-carboxy-3-hydroxyanisole PubChem CID: 591524 IUPAC Name: 2-hydroxy-6-methoxybenzoic acid SMILES: COC1=CC=CC(=C1C(=O)O)O

PubChem CID 591524
CAS 3147-64-6
Molecular Weight (g/mol) 168.15
SMILES COC1=CC=CC(=C1C(=O)O)O
Synonym 6-methoxysalicylic acid,6-hydroxy-o-anisic acid,benzoic acid, 2-hydroxy-6-methoxy,6-methoxysalicylicacid,6-methoxysalicylsaure,pubchem18380,acmc-1cldg,6-methoxy-salicylic acid,2-carboxy-3-methoxyphenol,2-carboxy-3-hydroxyanisole
IUPAC Name 2-hydroxy-6-methoxybenzoic acid
InChI Key AAUQLHHARJUJEH-UHFFFAOYSA-N
Molecular Formula C8H8O4
3,585
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3,5-Dichlorobenzhydrazide, 97%

CAS: 62899-78-9 Molecular Formula: C7H6Cl2N2O Molecular Weight (g/mol): 205.04 MDL Number: MFCD00833411 InChI Key: DNISXKBKTSHNKL-UHFFFAOYSA-N Synonym: 3,5-dichlorobenzhydrazide,3,5-dichlorobenzenecarbohydrazide,acmc-1b4zh,3,5-bis chloranyl benzohydrazide,3,5-dichlorobenzoic acid hydrazide,benzoic acid,3,5-dichloro-,hydrazide,benzoic acid,3,5-dichloro-, hydrazide PubChem CID: 2735966 IUPAC Name: 3,5-dichlorobenzohydrazide SMILES: NNC(=O)C1=CC(Cl)=CC(Cl)=C1

PubChem CID 2735966
CAS 62899-78-9
Molecular Weight (g/mol) 205.04
MDL Number MFCD00833411
SMILES NNC(=O)C1=CC(Cl)=CC(Cl)=C1
Synonym 3,5-dichlorobenzhydrazide,3,5-dichlorobenzenecarbohydrazide,acmc-1b4zh,3,5-bis chloranyl benzohydrazide,3,5-dichlorobenzoic acid hydrazide,benzoic acid,3,5-dichloro-,hydrazide,benzoic acid,3,5-dichloro-, hydrazide
IUPAC Name 3,5-dichlorobenzohydrazide
InChI Key DNISXKBKTSHNKL-UHFFFAOYSA-N
Molecular Formula C7H6Cl2N2O