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Substance Name: Ethyl 4-methylvalerate
RN: 25415-67-2
UNII: DZX6U00Q87
InChIKey: OFQRUTMGVBMTFQ-UHFFFAOYSA-N

Molecular Formula

  • C8-H16-O2

Molecular Weight

  • 144.212
 
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Names and Synonyms

Name of Substance

  • Ethyl 4-methylvalerate

Synonyms

  • AI3-33648
  • EINECS 246-955-9
  • UNII-DZX6U00Q87

Systematic Names

  • Ethyl 4-methylvalerate
  • Pentanoic acid, 4-methyl-, ethyl ester

Registry Numbers

CAS Registry Number

  • 25415-67-2

FDA UNII

  • DZX6U00Q87

System Generated Number

  • 0025415672

Structure Descriptors

InChI

1S/C8H16O2/c1-4-10-8(9)6-5-7(2)3/h7H,4-6H2,1-3H3

InChIKey

OFQRUTMGVBMTFQ-UHFFFAOYSA-N

Smiles

O=C(OCC)CCC(C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 163 deg C   EXP
log P (octanol-water) 2.760 (none)   EST
Atmospheric OH Rate Constant 6.15E-12 cm3/molecule-sec 25 EST

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