Cas no 5359-38-6 (Benzeneacetic acid,4-chloro-a-(4-chlorophenyl)-, methyl ester)

Benzeneacetic acid,4-chloro-a-(4-chlorophenyl)-, methyl ester structure
5359-38-6 structure
Product Name:Benzeneacetic acid,4-chloro-a-(4-chlorophenyl)-, methyl ester
CAS No:5359-38-6
MF:C15H12Cl2O2
MW:295.160582542419
CID:370026
PubChem ID:346996
Update Time:2025-04-19

Benzeneacetic acid,4-chloro-a-(4-chlorophenyl)-, methyl ester Chemical and Physical Properties

Names and Identifiers

    • Benzeneacetic acid,4-chloro-a-(4-chlorophenyl)-, methyl ester
    • methyl bis(4-chlorophenyl)ethanoate
    • Methyl bis(p-chlorophenyl)acetate
    • p,p'-DDA methyl ester
    • 5359-38-6
    • bis(4-chlorophenyl)acetic acid methyl ester
    • Acetic acid, bis(p-chlorophenyl)-, methyl ester
    • SCHEMBL1978245
    • UNII-V62132P4HJ
    • V62132P4HJ
    • Acetic acid, bis(p-chlorophenyl)-, methyl ester (8CI)
    • methyl bis(4-chlorophenyl) ethanoate
    • NSC-405404
    • Bis-(4-chloro-phenyl)-acetic acid methyl ester
    • DTXSID10201804
    • Q27291575
    • NSC405404
    • NSC 405404
    • Benzeneacetic acid, 4-chloro-.alpha.-(4-chlorophenyl)-, methyl ester
    • DDA methyl ester
    • Benzeneacetic acid, 4-chloro-alpha-(4-chlorophenyl)-, methyl ester
    • AI3-20280
    • Inchi: 1S/C15H12Cl2O2/c1-19-15(18)14(10-2-6-12(16)7-3-10)11-4-8-13(17)9-5-11/h2-9,14H,1H3
    • InChI Key: FIHLIVMWNUSLRU-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(=CC=1)C(C(=O)OC)C1C=CC(=CC=1)Cl

Computed Properties

  • Exact Mass: 294.02156
  • Monoisotopic Mass: 294.021
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 4
  • Complexity: 271
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 26.3?2
  • XLogP3: 4.8

Experimental Properties

  • Density: 1.283
  • Boiling Point: 386.4°Cat760mmHg
  • Flash Point: 149.7°C
  • Refractive Index: 1.578
  • PSA: 26.3
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