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Substance Name: 1,3-Propanediol, diacetate
RN: 628-66-0
InChIKey: DSVGICPKBRQDDX-UHFFFAOYSA-N

Molecular Formula

  • C7-H12-O4

Molecular Weight

  • 160.168
 
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Names and Synonyms

Synonym

  • AI3-07820

Systematic Name

  • 1,3-Propanediol, diacetate

Registry Numbers

CAS Registry Number

  • 628-66-0

System Generated Number

  • 0000628660

Structure Descriptors

InChI

1S/C7H12O4/c1-6(8)10-4-3-5-11-7(2)9/h3-5H2,1-2H3

InChIKey

DSVGICPKBRQDDX-UHFFFAOYSA-N

Smiles

O=C(OCCCOC(=O)C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 209.5 deg C   EXP
log P (octanol-water) 0.900 (none)   EST
Water Solubility 1.00E+05 mg/L   EXP
Atmospheric OH Rate Constant 5.17E-12 cm3/molecule-sec 25 EST

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