Name: (1R,2S,5R)-(+)-5-Methyl-2-(1-methyl-1-phenylethyl)cyclohexyl chloroacetate
Brand: ALDRICH

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About This Item

Empirical Formula (Hill Notation):

C₁₈H₂₅ClO₂

CAS Number:

71804-27-8

Molecular Weight:

308.84

MDL number:

MFCD00040610

UNSPSC Code:

12352101

PubChem Substance ID:

24860934

NACRES:

NA.22

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Assay

99%

form

solid

optical activity

[α]25/D +22°, c = 1.2 in carbon tetrachloride

mp

82-84 °C (lit.)

functional group

chloro
ester
phenyl

SMILES string

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)CCl)C(C)(C)c2ccccc2

InChI

1S/C18H25ClO2/c1-13-9-10-15(16(11-13)21-17(20)12-19)18(2,3)14-7-5-4-6-8-14/h4-8,13,15-16H,9-12H2,1-3H3/t13-,15-,16-/m1/s1

InChI key

GYWWQECFQIGECM-FVQBIDKESA-N

Application

(1R,2S,5R)-(+)-5-Methyl-2-(1-methyl-1-phenylethyl)cyclohexyl chloroacetate may be used in the synthesis of (-)-8-phenylmenthol, (+)-8-phenylmenthyl isocyanoacetate and (+)-cularine.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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