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Substance Name: Isopropyl isovalerate
RN: 32665-23-9
UNII: 7EVG31L4J8
InChIKey: ZOIRKXLFEHOVER-UHFFFAOYSA-N

Molecular Formula

  • C8-H16-O2

Molecular Weight

  • 144.212
 
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Names and Synonyms

Name of Substance

  • Isopropyl isovalerate

Synonyms

  • 1-Methylethyl 3-methylbutanoate
  • AI3-33617
  • Butanoic acid, 3-methyl-, 1-methylethyl ester
  • EINECS 251-145-3
  • FEMA No. 2961
  • Isopropyl 3-methylbutanoate
  • Isopropyl 3-methylbutyrate
  • Isopropyl isopentanoate
  • Isopropyl isovalerate
  • Isopropyl isovalianate
  • Isovaleric acid, isopropyl ester
  • UNII-7EVG31L4J8

Systematic Names

  • Butanoic acid, 3-methyl-, 1-methylethyl ester
  • Isopropyl isovalerate

Superlist Name

  • Isopropyl isovalerate

Registry Numbers

CAS Registry Number

  • 32665-23-9

FDA UNII

  • 7EVG31L4J8

Other Registry Number

  • 626-54-0

System Generated Number

  • 0032665239

Structure Descriptors

InChI

1S/C8H16O2/c1-6(2)5-8(9)10-7(3)4/h6-7H,5H2,1-4H3

InChIKey

ZOIRKXLFEHOVER-UHFFFAOYSA-N

Smiles

C(C(OC(C)C)=O)C(C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 142 deg C   EXP
log P (octanol-water) 2.680 (none)   EST
Atmospheric OH Rate Constant 6.52E-12 cm3/molecule-sec 25 EST

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