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40248-63-3

40248-63-3 Structure

40248-63-3 Structure
IdentificationMore
[Name]

(-)-MENTHOXYACETIC ACID
[CAS]

40248-63-3
[Synonyms]

2-[(2-ISOPROPYL-5-METHYLCYCLOHEXYL)OXY]ACETIC ACID
L-MENTHOXYACETIC ACID
(-)-MENTHOXYACETIC ACID
(-)-MENTHYLOXYACETIC ACID
Acetic acid, [[5-methyl-2-(1-methylethyl)cyclohexyl]oxy]-, [1R-(1alpha,2beta,5alpha)]-
L-p-menth-3-yloxyacetic acid
(-)-MENTHYLOXYACETIC ACID ABOUT 98%
(-)-MENTHOXYACETIC ACID 98+%
(-)-menthyl carboxymethyl ether
2-[((1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl)oxy]acetic acid
[((1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl)oxy]acetic acid
L-(Menthyloxy)acetic acid
[[(1R)-2α-Isopropyl-5β-methylcyclohexan-1β-yl]oxy]acetic acid
[[(1R,3R,4S)-p-Menthane-3-yl]oxy]acetic acid
[[(1R,3R,4S)-p-Menthane-3β-yl]oxy]acetic acid
[EINECS(EC#)]

254-857-2
[Molecular Formula]

C12H22O3
[MDL Number]

MFCD00001483
[Molecular Weight]

214.3
[MOL File]

40248-63-3.mol
Chemical PropertiesBack Directory
[Appearance]

white to light yellow crystal powde
[Melting point ]

52-55 °C(lit.)
[Boiling point ]

163-164 °C10 mm Hg(lit.)
[density ]

1.01 g/mL at 20 °C(lit.)
[refractive index ]

n20/D 1.4672(lit.)
[Fp ]

>230 °F
[storage temp. ]

2-8°C
[form ]

liquid
[pka]

3.47±0.10(Predicted)
[color ]

yellow
[Optical Rotation]

[α]25/D 92.5°, c = 4 in methanol
[BRN ]

2444474
[InChI]

1S/C12H22O3/c1-8(2)10-5-4-9(3)6-11(10)15-7-12(13)14/h8-11H,4-7H2,1-3H3,(H,13,14)/t9-,10+,11-/m1/s1
[InChIKey]

CILPHQCEVYJUDN-OUAUKWLOSA-N
[SMILES]

CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(O)=O
[CAS DataBase Reference]

40248-63-3(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[HS Code ]

29189900
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

L-Menthol
[Preparation Products]

Acemetacin-->(-)-MENTHOXYACETYL CHLORIDE
Hazard InformationBack Directory
[Chemical Properties]

white to light yellow crystal powde
[Uses]

(-)-Menthyloxyacetic acid can be used as a chiral resolving agent[1].
[References]

[1] Luo X, et al. Enantiomeric resolution, thermodynamic parameters, and modeling of clausenamidone and neoclausenamidone on polysaccharide-based chiral stationary phases. Chirality. 2019 Jun;31(6):423-433. doi: 10.1002/chir.23068. Epub 2019 Apr 24. DOI:10.1002/chir.23068
Spectrum DetailBack Directory
[Spectrum Detail]

(-)-MENTHOXYACETIC ACID(40248-63-3)MS
(-)-MENTHOXYACETIC ACID(40248-63-3)1HNMR
(-)-MENTHOXYACETIC ACID(40248-63-3)13CNMR
(-)-MENTHOXYACETIC ACID(40248-63-3)IR1
(-)-MENTHOXYACETIC ACID(40248-63-3)IR2
(-)-MENTHOXYACETIC ACID(40248-63-3)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

40248-63-3(sigmaaldrich)
[TCI AMERICA]

(-)-Menthoxyacetic Acid,>98.0%(T)(40248-63-3)
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