Cas no 773134-81-9 (benzoic acid, 4-chloro-3-(trifluoromethyl)-, ethyl ester)

benzoic acid, 4-chloro-3-(trifluoromethyl)-, ethyl ester structure
773134-81-9 structure
Product Name:benzoic acid, 4-chloro-3-(trifluoromethyl)-, ethyl ester
CAS No:773134-81-9
MF:C10H8ClF3O2
MW:252.617532730103
CID:1786984
PubChem ID:46311320
Update Time:2025-04-21

benzoic acid, 4-chloro-3-(trifluoromethyl)-, ethyl ester Chemical and Physical Properties

Names and Identifiers

    • benzoic acid, 4-chloro-3-(trifluoromethyl)-, ethyl ester
    • LogP
    • E89878
    • CS-0191040
    • DTXSID201267308
    • SCHEMBL403261
    • DB-157717
    • ethyl 4-chloro-3-(trifluoromethyl)benzoate
    • ethyl 4-chloro-3-trifluoromethylbenzoate
    • starbld0049167
    • MFCD06204386
    • 773134-81-9
    • 4-Chloro-3-trifluoromethyl-benzoic acid ethyl ester
    • Inchi： 1S/C10H8ClF3O2/c1-2-16-9(15)6-3-4-8(11)7(5-6)10(12,13)14/h3-5H,2H2,1H3
    • InChI Key： JGRYXJCSMVVDHR-UHFFFAOYSA-N
    • SMILES： ClC1=CC=C(C(=O)OCC)C=C1C(F)(F)F

Computed Properties

  • Exact Mass: 252.0164917g/mol
  • Monoisotopic Mass: 252.0164917g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 255
  • 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
  • XLogP3: 3.7
  • Topological Polar Surface Area: 26.3?2

benzoic acid, 4-chloro-3-(trifluoromethyl)-, ethyl ester Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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