Cas no 306935-76-2 (2-Butenoic acid,4-[(2,5-dichlorophenyl)amino]-4-oxo-)

2-Butenoic acid,4-[(2,5-dichlorophenyl)amino]-4-oxo- structure
306935-76-2 structure
Product Name:2-Butenoic acid,4-[(2,5-dichlorophenyl)amino]-4-oxo-
CAS No:306935-76-2
MF:C10H7Cl2NO3
MW:260.073480844498
CID:300143
PubChem ID:1551520
Update Time:2025-04-19

2-Butenoic acid,4-[(2,5-dichlorophenyl)amino]-4-oxo- Chemical and Physical Properties

Names and Identifiers

    • 2-Butenoic acid,4-[(2,5-dichlorophenyl)amino]-4-oxo-
    • 3-(2,5-DICHLORO-PHENYLCARBAMOYL)-ACRYLIC ACID
    • N-(2,5-DICHLOROPHENYL)MALEAMIC ACID
    • 4-(2,5-dichloroanilino)-4-oxo-2-butenoic acid
    • AKOS AUF0566
    • ASISCHEM D13261
    • 31460-32-9
    • (Z)-4-((2,5-dichlorophenyl)amino)-4-oxobut-2-enoic acid
    • (Z)-4-(2,5-dichloroanilino)-4-oxobut-2-enoic acid
    • (2Z)-4-[(2,5-Dichlorophenyl)amino]-4-oxo-2-butenoic acid
    • 5135-47-7
    • 306935-76-2
    • F1097-0012
    • MFCD00082906
    • SR-01000196565
    • (Z)-4-((2,5-dichlorophenyl)amino)-4-oxobut-2-enoicacid
    • DTXSID001200481
    • AKOS000296115
    • SR-01000196565-1
    • Inchi: 1S/C10H7Cl2NO3/c11-6-1-2-7(12)8(5-6)13-9(14)3-4-10(15)16/h1-5H,(H,13,14)(H,15,16)/b4-3-
    • InChI Key: WSKTYRGKGHEEDM-ARJAWSKDSA-N
    • SMILES: ClC1C=CC(=CC=1NC(/C=C\C(=O)O)=O)Cl

Computed Properties

  • Exact Mass: 258.98000
  • Monoisotopic Mass: 258.98
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 306
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2
  • Topological Polar Surface Area: 66.4A^2

Experimental Properties

  • PSA: 66.40000
  • LogP: 2.64570

2-Butenoic acid,4-[(2,5-dichlorophenyl)amino]-4-oxo- Security Information

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