[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] acetate

CAS: 5157-89-1

Molecular Formula	`C12H22O2`
Molecular Weight	198.3 g/mol
LogP	3.6
Topological Polar Surface Area	26.3 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	3
Exact Mass	198.16199
Heavy Atoms	14
Complexity	198.0

Chemical Identifiers

CAS Number	5157-89-1
SMILES	`CC1CCC(C(C1)OC(=O)C)C(C)C`
InChIKey	`XHXUANMFYXWVNG-WCQGTBRESA-N`

📖 Product Overview

[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] acetate (CAS: 5157-89-1) is a chemical compound with molecular formula C12H22O2 and molecular weight 198.3 g/mol. Its IUPAC systematic name is [(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl] acetate. LogP 3.6 Topological Polar Surface Area 26.3 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 2 Rotatable Bonds 3 Exact Mass 198.16199 Heavy Atoms 14 Complexity 198.0 InChI Key: XHXUANMFYXWVNG-WCQGTBRESA-N. SMILES: CC1CCC(C(C1)OC(=O)C)C(C)C.

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