6-{[2-(4-Chlorobenzoyl)hydrazino]carbonyl}-3-cyclohexene-1-carboxylic acid

Base Information

• Chemical Name: 6-{[2-(4-Chlorobenzoyl)hydrazino]carbonyl}-3-cyclohexene-1-carboxylic acid
• CAS No.: 451485-61-3
• Molecular Formula: C15H15ClN2O4
• Molecular Weight: 322.74
• DSSTox Substance ID: DTXSID201156236
• ChEMBL ID: CHEMBL1522757
• Mol file: 451485-61-3.mol

Synonyms:6-{[2-(4-chlorobenzoyl)hydrazino]carbonyl}-3-cyclohexene-1-carboxylic acid;451485-61-3;6-[[(4-chlorobenzoyl)amino]carbamoyl]cyclohex-3-ene-1-carboxylic Acid;6-{[(4-chlorophenyl)formohydrazido]carbonyl}cyclohex-3-ene-1-carboxylic acid;MLS000755321;CHEMBL1522757;DTXSID201156236;HMS2633L24;HMS3363A12;MFCD02186201;STK425484;AKOS003281562;AKOS016340017;SMR000338184;CS-0327256;3R-0254;6-(2-(4-Chlorobenzoyl)hydrazinecarbonyl)cyclohex-3-enecarboxylicacid;4-Cyclohexene-1,2-dicarboxylic acid, 1-[2-(4-chlorobenzoyl)hydrazide];6-(2-(4-Chlorobenzoyl)hydrazinecarbonyl)cyclohex-3-enecarboxylic acid;6-({2-[(4-chlorophenyl)carbonyl]hydrazinyl}carbonyl)cyclohex-3-ene-1-carboxylic acid;6-(2-(4-Chlorobenzoyl)hydrazine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid

Chemical Property of 6-{[2-(4-Chlorobenzoyl)hydrazino]carbonyl}-3-cyclohexene-1-carboxylic acid

Chemical Property:

• PKA: 4.27±0.40(Predicted)
• XLogP3: 2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 322.0720347
• Heavy Atom Count: 22
• Complexity: 472

Purity/Quality:

98%min ^*data from raw suppliers

6-{[2-(4-Chlorobenzoyl)hydrazino]carbonyl}-3-cyclohexene-1-carboxylic acid >95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1C=CCC(C1C(=O)NNC(=O)C2=CC=C(C=C2)Cl)C(=O)O