Validol
CAS Registry Number®
28221-20-7
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CAS Name
ValidolMolecular Formula
C15H28O2Molecular Mass
240.38Cite this Page
Validol. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=28221-20-7 (retrieved ) (CAS RN: 28221-20-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Density (1)
0.9241 g/cm³ @ Temp: 15 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/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-/m1/s1
InChIKey
InChIKey=VYQSSWZYPCCBRN-HZSPNIEDSA-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
- Menthol, isovalerate
- Butanoic acid, 3-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester, [1R-(1α,2β,5α)]-
- Validol
- Menthoval
Deleted or Replaced CAS Registry Numbers
10403-25-5
