Cas no 178181-51-6 (Carbamic acid,(3-fluoropropyl)-, 1,1-dimethylethyl ester (9CI))

Carbamic acid,(3-fluoropropyl)-, 1,1-dimethylethyl ester (9CI) structure
178181-51-6 structure
Product Name:Carbamic acid,(3-fluoropropyl)-, 1,1-dimethylethyl ester (9CI)
CAS No:178181-51-6
MF:C8H16FNO2
MW:177.216546058655
MDL:MFCD23703459
CID:112822
PubChem ID:45092379
Update Time:2025-04-18

Carbamic acid,(3-fluoropropyl)-, 1,1-dimethylethyl ester (9CI) Chemical and Physical Properties

Names and Identifiers

    • Carbamic acid,(3-fluoropropyl)-, 1,1-dimethylethyl ester (9CI)
    • TERT-BUTYL (3-FLUOROPROPYL)CARBAMATE
    • Carbamic acid, (3-fluoropropyl)-, 1,1-dimethylethyl ester (9CI)
    • tert-butyl N-(3-fluoropropyl)carbamate
    • tert-butyl 3-fluoropropylcarbamate
    • TERT-BUTYL(3-FLUOROPROPYL)CARBAMATE
    • MFCD23703459
    • PWCMDZUAQPMAHW-UHFFFAOYSA-N
    • CS-0346630
    • EN300-7172675
    • SCHEMBL1235964
    • 178181-51-6
    • MDL: MFCD23703459
    • Inchi: 1S/C8H16FNO2/c1-8(2,3)12-7(11)10-6-4-5-9/h4-6H2,1-3H3,(H,10,11)
    • InChI Key: PWCMDZUAQPMAHW-UHFFFAOYSA-N
    • SMILES: FCCCNC(=O)OC(C)(C)C

Computed Properties

  • Exact Mass: 177.11658
  • Monoisotopic Mass: 177.117
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 5
  • Complexity: 143
  • 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: 38.3A^2
  • XLogP3: 1.6

Experimental Properties

  • PSA: 38.33

Carbamic acid,(3-fluoropropyl)-, 1,1-dimethylethyl ester (9CI) Pricemore >>

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