CAS 2552-91-2: Cyclohexanol, 5-methyl-2-(1-methylethyl)-, 1-acetate, (1S,2S,5R)-

Description: Cyclohexanol, 5-methyl-2-(1-methylethyl)-, 1-acetate, (1S,2S,5R)-, with CAS number 2552-91-2, is an organic compound characterized by its cyclic structure and functional groups. It features a cyclohexanol backbone, which is a six-membered carbon ring with a hydroxyl (-OH) group, indicating it is an alcohol. The presence of a methyl group and an isopropyl group on the cyclohexanol ring contributes to its branched structure, influencing its physical and chemical properties. The acetate functional group suggests that it is an ester, which typically enhances its volatility and solubility in organic solvents. This compound is likely to exhibit moderate polarity due to the hydroxyl group, while the acetate moiety can impart additional reactivity, particularly in esterification and hydrolysis reactions. Its stereochemistry, denoted by the (1S,2S,5R) configuration, indicates specific spatial arrangements of its substituents, which can affect its biological activity and interactions. Overall, this compound may find applications in organic synthesis, fragrance formulations, or as an intermediate in chemical manufacturing.

Formula: C₁₂H₂₂O₂

InChI: InChI=1S/C12H22O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h8-9,11-12H,5-7H2,1-4H3/t9-,11+,12+/m1/s1

InChI key: InChIKey=XHXUANMFYXWVNG-USWWRNFRSA-N

SMILES: O=C(OC1CC(C)CCC1C(C)C)C

Synonyms:

• (+)-Neomenthyl acetate
• (1S)-(+)-Neomenthyl acetate
• (1S,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexyl acetate
• Cyclohexanol, 5-methyl-2-(1-methylethyl)-, 1-acetate, (1S,2S,5R)-
• Cyclohexanol, 5-methyl-2-(1-methylethyl)-, acetate, (1S,2S,5R)-
• Cyclohexanol, 5-methyl-2-(1-methylethyl)-, acetate, [1S-(1α,2α,5β)]-
• Menthol, acetate, (1R,3S,4S)-(+)-
• NSC 7350
• d-Neomenthyl acetate
• (1S,2S,5R)-(+)-Neomenthyl acetate

(1S)-(+)-Neomenthyl acetate

CAS: 2552-91-2

• Formula: C₁₂H₂₂O₂
• Purity: 95%
• Color and Shape: Liquid
• Molecular weight: 198.3019

Neomenthyl Acetate

CAS: 2552-91-2

• Formula: C₁₂H₂₂O₂
• Molecular weight: 198.31

(+)-Neomenthyl Acetate

CAS: 2552-91-2

• Formula: C₁₂H₂₂O₂
• Color and Shape: Neat
• Molecular weight: 198.30

(5S)-2-isopropyl-5-methylcyclohexyl acetate

CAS: 2552-91-2

• Purity: 98%
• Molecular weight: 198.30599975585938

(+)-Neomenthyl acetate

CAS: 2552-91-2

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• Formula: C₁₂H₂₂O₂
• Purity: Min. 95%
• Molecular weight: 198.3 g/mol