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methyl 4-hydroxycyclohexane-1-carboxylate

methyl 4-hydroxycyclohexane-1-carboxylate

CAS: 17449-76-2

Formula: C8H14O3

SMILES: COC(=O)C1CCC(O)CC1

IUPAC: methyl 4-hydroxycyclohexane-1-carboxylate

InChI: InChI=1S/C8H14O3/c1-11-8(10)6-2-4-7(9)5-3-6/h6-7,9H,2-5H2,1H3

Composition: C (60.74%), H (8.92%), O (30.34%)

Molar Mass: 158.197

Atom Count: 25

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 158.094294311
Formal Charge 0
FSP3 0.87
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey HYDYVXROZHFTGB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.28
Topological Polar Surface Area 46.53
Polarizability 16.16
Ring Count 1
Rotatable Bond Count 2

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97% <6 Days 17449-76-2 $18.40-$74.75$18.40$24.15$37.95$74.75
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