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4,4-difluoro-1-(hydroxymethyl)cyclohexan-1-ol

4,4-difluoro-1-(hydroxymethyl)cyclohexan-1-ol

CAS: 1256545-48-8

Formula: C7H12F2O2

SMILES: OCC1(O)CCC(F)(F)CC1

IUPAC: 4,4-difluoro-1-(hydroxymethyl)cyclohexan-1-ol

InChI: InChI=1S/C7H12F2O2/c8-7(9)3-1-6(11,5-10)2-4-7/h10-11H,1-5H2

Composition: C (50.60%), H (7.28%), F (22.87%), O (19.26%)

Molar Mass: 166.168

Atom Count: 23

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 166.080535952
Formal Charge 0
FSP3 1
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey UWQNBBJRNAMXKK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 36.05
Topological Polar Surface Area 40.46
Polarizability 13.8
Ring Count 1
Rotatable Bond Count 1

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