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Home > Fluorides > 1256545-48-8
1256545-48-8 | Cyclohexanemethanol, 4,4-difluoro-1-hydroxy-
CAS No: 1256545-48-8 Catalog No: AG000O9Q MDL No:MFCD27942592
Product Description
Catalog Number:
AG000O9Q
Chemical Name:
Cyclohexanemethanol, 4,4-difluoro-1-hydroxy-
CAS Number:
1256545-48-8
Molecular Formula:
C7H12F2O2
Molecular Weight:
166.1658
MDL Number:
MFCD27942592
IUPAC Name:
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
InChI Key:
UWQNBBJRNAMXKK-UHFFFAOYSA-N
SMILES:
OCC1(O)CCC(CC1)(F)F
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.081g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
166.168g/mol
Monoisotopic Mass:
166.081g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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