Cas no 2145-87-1 (Carbamic acid,(2,4-difluorophenyl)-, ethyl ester (9CI))

Carbamic acid,(2,4-difluorophenyl)-, ethyl ester (9CI) structure
2145-87-1 structure
Product Name:Carbamic acid,(2,4-difluorophenyl)-, ethyl ester (9CI)
CAS No:2145-87-1
MF:C9H9F2NO2
MW:201.1700694561
CID:283778
PubChem ID:242728
Update Time:2025-04-19

Carbamic acid,(2,4-difluorophenyl)-, ethyl ester (9CI) Chemical and Physical Properties

Names and Identifiers

    • Carbamic acid,(2,4-difluorophenyl)-, ethyl ester (9CI)
    • ethyl N-(2,4-difluorophenyl)carbamate
    • Carbamic acid, (2,4-difluorophenyl)-, ethyl ester
    • NSC51597
    • SCHEMBL9175285
    • BPSIMPGQOACUJF-UHFFFAOYSA-N
    • N-(2,4-difluorophenyl)carbamic acid ethyl ester
    • Maybridge1_007909
    • A817350
    • 2145-87-1
    • HMS563P11
    • NSC-51597
    • ethyl N-[2,4-bis(fluoranyl)phenyl]carbamate
    • AKOS003868767
    • CCG-250255
    • DTXSID60287572
    • Inchi: 1S/C9H9F2NO2/c1-2-14-9(13)12-8-4-3-6(10)5-7(8)11/h3-5H,2H2,1H3,(H,12,13)
    • InChI Key: BPSIMPGQOACUJF-UHFFFAOYSA-N
    • SMILES: FC1C=C(C=CC=1NC(=O)OCC)F

Computed Properties

  • Exact Mass: 201.06017
  • Monoisotopic Mass: 201.06
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 201
  • 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: 2.2
  • Topological Polar Surface Area: 38.3?2

Experimental Properties

  • Density: 1.307
  • Boiling Point: 194.6°Cat760mmHg
  • Flash Point: 71.5°C
  • Refractive Index: 1.521
  • PSA: 38.33
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