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Substance Name: Bornyl isovalerate, D-
RN: 53022-14-3
UNII: NUZ9YO009K
InChIKey: MPYYVGIJHREDBO-XUJVJEKNSA-N

Molecular Formula

  • C15-H26-O2

Molecular Weight

  • 238.3684
 
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Names and Synonyms

Name of Substance

  • Bornyl isovalerate, D-

Synonyms

  • Bornyl isovalerate, D-
  • Butanoic acid, 3-methyl-, 1,7,7-trimethylbicyclo(2.2.1)hept-2-yl ester, (1R-endo)-
  • D-Bornyl isovalerate
  • D-Bornyl isovalerate [MI]
  • Isovaleric acid D-bornyl ester
  • UNII-NUZ9YO009K

Registry Numbers

CAS Registry Number

  • 53022-14-3

FDA UNII

  • NUZ9YO009K

System Generated Number

  • 0053022143

Structure Descriptors

InChI

1S/C15H26O2/c1-10(2)8-13(16)17-12-9-11-6-7-15(12,5)14(11,3)4/h10-12H,6-9H2,1-5H3/t11-,12+,15+/m1/s1

InChIKey

MPYYVGIJHREDBO-XUJVJEKNSA-N

Smiles

CC(C)CC(=O)O[C@H]1C[C@H]2CC[C@@]1(C2(C)C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point < 25 deg C   EXP
Boiling Point 257.5 deg C   EXP
log P (octanol-water) 5.260 (none)   EST
Atmospheric OH Rate Constant 1.08E-11 cm3/molecule-sec 25 EST

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