Cas no 173605-13-5 (crotonic acid, octyl ester, trans-)

crotonic acid, octyl ester, trans- structure
173605-13-5 structure
Product Name:crotonic acid, octyl ester, trans-
CAS No:173605-13-5
MF:C12H22O2
MW:198.301884174347
CID:905897
Update Time:2024-06-15

crotonic acid, octyl ester, trans- Chemical and Physical Properties

Names and Identifiers

    • crotonic acid, octyl ester, trans-
    • 2-Butenoic acid, octyl ester, (2E)-
    • Inchi: 1S/C12H22O2/c1-3-5-6-7-8-9-11-14-12(13)10-4-2/h4,10H,3,5-9,11H2,1-2H3/b10-4+
    • InChI Key: HULBECQFWZPEBI-ONNFQVAWSA-N
    • SMILES: C(OCCCCCCCC)(=O)/C=C/C

Computed Properties

  • Exact Mass: 198.16206

Experimental Properties

  • Density: 0.886±0.06 g/cm3(Predicted)
  • Boiling Point: 254.9±9.0 °C(Predicted)
  • PSA: 26.3

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