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Substance Name: Amyl heptanoate
RN: 7493-82-5
UNII: I91PDA80HT
InChIKey: PSQMUBJRXIGVIT-UHFFFAOYSA-N

Molecular Formula

  • C12-H24-O2

Molecular Weight

  • 200.32
 
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Names and Synonyms

Name of Substance

  • Amyl heptanoate

Synonyms

  • AI3-33582
  • Amyl heptanoate
  • Amyl heptoate
  • Amyl heptylate
  • Amyl oenanthate
  • EINECS 231-342-0
  • FEMA No. 2073
  • Heptanoic acid, pentyl ester
  • NSC 46129
  • Pentyl heptanoate
  • UNII-I91PDA80HT

Systematic Names

  • Heptanoic acid, pentyl ester
  • Pentyl heptanoate

Superlist Name

  • Amyl heptanoate

Registry Numbers

CAS Registry Number

  • 7493-82-5

FDA UNII

  • I91PDA80HT

System Generated Number

  • 0007493825

Structure Descriptors

InChI

InChI=1S/C12H24O2/c1-3-5-7-8-10-12(13)14-11-9-6-4-2/h3-11H2,1-2H3

InChIKey

PSQMUBJRXIGVIT-UHFFFAOYSA-N

Smiles

CCCCCCC(=O)OCCCCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -5.00E+01 deg C   EXP
Boiling Point 245.4 deg C   EXP
log P (octanol-water) 4.790 (none)   EST
Atmospheric OH Rate Constant 1.19E-11 cm3/molecule-sec 25 EST

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