Cas no 2097713-63-6 ((1S)-1-(3-fluoro-4-nitrophenyl)ethan-1-ol)

(1S)-1-(3-fluoro-4-nitrophenyl)ethan-1-ol structure
2097713-63-6 structure
Product Name:(1S)-1-(3-fluoro-4-nitrophenyl)ethan-1-ol
CAS No:2097713-63-6
MF:C8H8FNO3
MW:185.152425765991
MDL:MFCD31417450
CID:5140265
PubChem ID:137346864
Update Time:2026-03-03

(1S)-1-(3-fluoro-4-nitrophenyl)ethan-1-ol Chemical and Physical Properties

Names and Identifiers

    • (S)-1-(3-fluoro-4-nitrophenyl)ethanol
    • Benzenemethanol, 3-fluoro-α-methyl-4-nitro-, (αS)-
    • (1S)-1-(3-fluoro-4-nitrophenyl)ethan-1-ol
    • 2097713-63-6
    • EN300-1866412
    • MFCD31417450
    • G63344
    • SCHEMBL26352680
    • (1S)-1-(3-fluoro-4-nitrophenyl)ethanol
    • MDL: MFCD31417450
    • Inchi: 1S/C8H8FNO3/c1-5(11)6-2-3-8(10(12)13)7(9)4-6/h2-5,11H,1H3/t5-/m0/s1
    • InChI Key: BBJICPBIVRCRDH-YFKPBYRVSA-N
    • SMILES: [C@@H](O)(C1=CC=C([N+]([O-])=O)C(F)=C1)C

Computed Properties

  • Exact Mass: 185.04882128g/mol
  • Monoisotopic Mass: 185.04882128g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 194
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.4
  • Topological Polar Surface Area: 66?2

(1S)-1-(3-fluoro-4-nitrophenyl)ethan-1-ol Pricemore >>

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