Cas no 55881-94-2 (2-methylidenebutane-1,4-diol)

2-methylidenebutane-1,4-diol structure
2-methylidenebutane-1,4-diol structure
Product Name:2-methylidenebutane-1,4-diol
CAS No:55881-94-2
MF:C5H10O2
MW:102.131701946259
CID:350367
PubChem ID:11446296
Update Time:2025-04-19

2-methylidenebutane-1,4-diol Chemical and Physical Properties

Names and Identifiers

    • 1,4-Butanediol, 2-methylene-
    • 2-methylidenebutane-1,4-diol
    • SCHEMBL4137353
    • DTXSID30466019
    • 2-Methylene-1,4-butanediol
    • 2-methylenebutan-1,4-diol
    • 55881-94-2
    • CHEBI:131368
    • 2-methylene-butane-1,4-diol
    • YAJSVGNJAFUMAC-UHFFFAOYSA-N
    • Inchi: 1S/C5H10O2/c1-5(4-7)2-3-6/h6-7H,1-4H2
    • InChI Key: YAJSVGNJAFUMAC-UHFFFAOYSA-N
    • SMILES: OCCC(=C)CO

Computed Properties

  • Exact Mass: 102.0681
  • Monoisotopic Mass: 102.068079557g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 3
  • Complexity: 59.1
  • 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: 0
  • Topological Polar Surface Area: 40.5?2

Experimental Properties

  • PSA: 40.46

2-methylidenebutane-1,4-diol Pricemore >>

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