(-)-Menthoxyacetyl chloride

C12H21ClO2CAS 15356-62-4232.75 g/mol

Open in Covalent MOL file
OOCl
Acyl halideEther

Properties

Molecular formula
C12H21ClO2
Molar mass
232.75 g/mol
Exact mass
232.1230 Da
logP
3.23Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
4
Stereocentres
R, S, Rin SMILES atom order

Hazards

Danger
Corrosive (GHS05)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501

Identifiers

CAS number
15356-62-4
SMILES
C[C@@H]1CC[C@H]([C@@H](C1)OCC(=O)Cl)C(C)C
InChIKey
VNMCKLVHDJADEB-OUAUKWLOSA-N
InChI
InChI=1S/C12H21ClO2/c1-8(2)10-5-4-9(3)6-11(10)15-7-12(13)14/h8-11H,4-7H2,1-3H3/t9-,10+,11-/m1/s1

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Work with (-)-Menthoxyacetyl chloride

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

Similar compounds

2-[[(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl]oxy]acetic acid40248-63-365 % similar (-)-Menthyl chloroformate14602-86-960 % similar (+)-Menthyl chloroformate7635-54-360 % similar Menthyl acetate16409-45-354 % similar Menthyl acetate2623-23-654 % similar (±)-Menthyl acetate89-48-554 % similar (1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl 2,2-dihydroxyacetate111969-64-350 % similar (-)-Menthyl glyoxylate26315-61-750 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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