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2-methylcyclohexyl acetate

2-methylcyclohexyl acetate

CAS: 5726-19-2

Formula: C9H16O2

SMILES: CC1CCCCC1OC(C)=O

IUPAC: 2-methylcyclohexyl acetate

InChI: InChI=1/C9H16O2/c1-7-5-3-4-6-9(7)11-8(2)10/h7,9H,3-6H2,1-2H3

Composition: C (69.19%), H (10.32%), O (20.48%)

Molar Mass: 156.225

Atom Count: 27

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 156.115029755
Formal Charge 0
FSP3 0.89
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey AKIIJALHGMKJEJ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 42.9
Topological Polar Surface Area 26.3
Polarizability 17.34
Ring Count 1
Rotatable Bond Count 2

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