Menthyl valerate

CAS Registry Number®

89-47-4

CAS Name

Menthyl valerate

Molecular Formula

C15H28O2

Molecular Mass

240.38

Cite this Page

Menthyl valerate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=89-47-4 (retrieved 2024-11-22) (CAS RN: 89-47-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    <25 °C

  • Density (2)

    0.906-0.908 g/cm³

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
  • (2) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1/C15H28O2/c1-10(2)8-15(16)17-14-9-12(5)6-7-13(14)11(3)4/h10-14H,6-9H2,1-5H3/t12-,13+,14-/s2

InChIKey

InChIKey=VYQSSWZYPCCBRN-RDMRCOCINA-N

SMILES

C(C)(C)[C@H]1[C@H](OC(CC(C)C)=O)C[C@H](C)CC1

Canonical SMILES

O=C(OC1CC(C)CCC1C(C)C)CC(C)C

Other Names for this Substance

  • Butanoic acid, 3-methyl-, (1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester, rel-
  • Menthol, isovalerate
  • Butanoic acid, 3-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester, (1α,2β,5α)-
  • Isovaleric acid menthyl ester
  • p-Menth-3-yl isovalerate

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Deleted or Replaced CAS Registry Numbers

8003-25-6

CAS INSIGHTSTM
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