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Substance Name: Propyl heptanoate
RN: 7778-87-2
UNII: 43257OA2O9
InChIKey: UWZVPQKWYFZLLW-UHFFFAOYSA-N

Molecular Formula

  • C10-H20-O2

Molecular Weight

  • 172.266
 
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Names and Synonyms

Name of Substance

  • Propyl heptanoate

Synonyms

  • AI3-30737
  • EINECS 231-917-6
  • FEMA No. 2948
  • Heptanoic acid, propyl ester
  • Propyl heptanoate
  • Propyl heptoate
  • Propyl heptylate
  • UNII-43257OA2O9

Systematic Names

  • Heptanoic acid, propyl ester
  • Propyl heptanoate

Superlist Name

  • Propyl heptanoate

Registry Numbers

CAS Registry Number

  • 7778-87-2

FDA UNII

  • 43257OA2O9

System Generated Number

  • 0007778872

Structure Descriptors

InChI

1S/C10H20O2/c1-3-5-6-7-8-10(11)12-9-4-2/h3-9H2,1-2H3

InChIKey

UWZVPQKWYFZLLW-UHFFFAOYSA-N

Smiles

C(=O)(OCCC)CCCCCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -6.35E+01 deg C   EXP
Boiling Point 208 deg C   EXP
log P (octanol-water) 3.810 (none)   EST
Atmospheric OH Rate Constant 9.07E-12 cm3/molecule-sec 25 EST

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