chempirical

(-)-Menthyl chloroformate

C11H19ClO2CAS 14602-86-9218.72 g/mol

Open in Covalent MOL file
OOCl
Acyl halide

Properties

Molecular formula
C11H19ClO2
Molar mass
218.72 g/mol
Exact mass
218.1074 Da
logP
3.82Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
14602-86-9
SMILES
CC1CCC(C(C1)OC(=O)Cl)C(C)C
InChIKey
KIUPCUCGVCGPPA-UHFFFAOYSA-N
InChI
InChI=1S/C11H19ClO2/c1-7(2)9-5-4-8(3)6-10(9)14-11(12)13/h7-10H,4-6H2,1-3H3

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Names and synonyms

1 names
  • Menthyl chloroformate

Work with (-)-Menthyl chloroformate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(+)-Menthyl chloroformate7635-54-3Defined stereoisomer

Similar compounds

Menthyl acetate16409-45-365 % similar Menthyl acetate2623-23-665 % similar (±)-Menthyl acetate89-48-565 % similar (1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl 2,2-dihydroxyacetate111969-64-364 % similar Menthyl lactate17162-29-763 % similar l-Menthyl D-lactate59259-38-063 % similar L-Menthyl L-lactate61597-98-663 % similar (-)-Menthoxyacetyl chloride15356-62-460 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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