Cas no 153774-39-1 (Allyl 3-amino-4-fluorobenzoate)

Allyl 3-amino-4-fluorobenzoate structure
153774-39-1 structure
Product Name:Allyl 3-amino-4-fluorobenzoate
CAS No:153774-39-1
MF:C10H10FNO2
MW:195.190306186676
MDL:MFCD20723071
CID:106325
PubChem ID:22168565
Update Time:2025-09-27

Allyl 3-amino-4-fluorobenzoate Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,3-amino-4-fluoro-, 2-propen-1-yl ester
    • Allyl 3-amino-4-fluorobenzoate
    • Benzoic acid, 3-amino-4-fluoro-, 2-propenyl ester (9CI)
    • AK438415
    • 153774-39-1
    • SCHEMBL5108824
    • MFCD20723071
    • AKOS027398825
    • Allyl3-amino-4-fluorobenzoate
    • CS-0187301
    • C72906
    • prop-2-enyl 3-amino-4-fluorobenzoate
    • DS-18799
    • PROP-2-EN-1-YL 3-AMINO-4-FLUOROBENZOATE
    • MDL: MFCD20723071
    • Inchi: 1S/C10H10FNO2/c1-2-5-14-10(13)7-3-4-8(11)9(12)6-7/h2-4,6H,1,5,12H2
    • InChI Key: SNZWNIMUYPJNCE-UHFFFAOYSA-N
    • SMILES: FC1C=CC(C(=O)OCC=C)=CC=1N

Computed Properties

  • Exact Mass: 195.0696
  • Monoisotopic Mass: 195.07
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 220
  • 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: 52.3
  • XLogP3: 1.8

Experimental Properties

  • PSA: 52.32

Allyl 3-amino-4-fluorobenzoate Pricemore >>

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