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Substance Name: Angelica lactone
RN: 1333-38-6
InChIKey: BGLUXFNVVSVEET-UHFFFAOYSA-N

Molecular Formula

  • C5-H6-O2

Molecular Weight

  • 98.1004
 
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Names and Synonyms

Name of Substance

  • Angelica lactone

Synonyms

  • CCRIS 2925
  • EINECS 215-586-5

Systematic Names

  • 2(?H)-Furanone, 5-methyl-
  • 5-Methylfuran-2-one
  • Angelica lactone

Registry Numbers

CAS Registry Number

  • 1333-38-6

System Generated Number

  • 0001333386

Structure Descriptors

InChI

1S/C5H6O2/c1-4-2-3-5(6)7-4/h2-4H,1H3

InChIKey

BGLUXFNVVSVEET-UHFFFAOYSA-N

Smiles

O1C(C=C[C@@H]1C)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 18 deg C   EXP
Boiling Point 210 deg C   EXP
log P (octanol-water) -0.120 (none)   EST
Water Solubility 5.00E+04 mg/L 15 EXP
Atmospheric OH Rate Constant 7.22E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.