Cas no 720678-21-7 (1-Chloro-3-fluoro-2-isocyanatobenzene)

1-Chloro-3-fluoro-2-isocyanatobenzene structure
720678-21-7 structure
Product Name:1-Chloro-3-fluoro-2-isocyanatobenzene
CAS No:720678-21-7
MF:C7H3ClFNO
MW:171.556224107742
MDL:MFCD08444547
CID:1752553
PubChem ID:16227836
Update Time:2025-09-22

1-Chloro-3-fluoro-2-isocyanatobenzene Chemical and Physical Properties

Names and Identifiers

    • Benzene, 1-chloro-3-fluoro-2-isocyanato-
    • SCHEMBL1950281
    • 720678-21-7
    • 2-chloro-6-fluorophenyl isocyanate
    • 1-chloro-3-fluoro-2-isocyanatobenzene
    • MFCD08444547
    • 1-chloro-3-fluoro-2-isocyanatobenzene, AldrichCPR
    • AKOS004910807
    • EN300-27127
    • FS-5337
    • 1-Chloro-3-fluoro-2-isocyanatobenzene
    • MDL: MFCD08444547
    • Inchi: 1S/C7H3ClFNO/c8-5-2-1-3-6(9)7(5)10-4-11/h1-3H
    • InChI Key: KMDUNDOCWFAOSP-UHFFFAOYSA-N
    • SMILES: ClC1C=CC=C(C=1N=C=O)F

Computed Properties

  • Exact Mass: 170.98879
  • Monoisotopic Mass: 170.9887196g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 181
  • 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: 3.5
  • Topological Polar Surface Area: 29.4?2

Experimental Properties

  • PSA: 29.43

1-Chloro-3-fluoro-2-isocyanatobenzene Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI XIAN DING Biotechnology Co., Ltd.
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$ 80.00 2022-06-06
Apollo Scientific
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£148.00 2025-02-22
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A2B Chem LLC
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$293.00 2024-04-19
abcr
AB411590-250mg
1-Chloro-3-fluoro-2-isocyanatobenzene; .
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abcr
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