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Home > Fluorides > 933674-49-8
933674-49-8 | trans-2-(3,4-Difluorophenyl)cyclohexanol
CAS No: 933674-49-8 Catalog No: AG01FC5I MDL No:
Product Description
Catalog Number:
AG01FC5I
Chemical Name:
trans-2-(3,4-Difluorophenyl)cyclohexanol
CAS Number:
933674-49-8
Molecular Formula:
C12H14F2O
Molecular Weight:
212.2358
IUPAC Name:
2-(3,4-difluorophenyl)cyclohexan-1-ol
InChI:
InChI=1S/C12H14F2O/c13-10-6-5-8(7-11(10)14)9-3-1-2-4-12(9)15/h5-7,9,12,15H,1-4H2
InChI Key:
IUZJQZVSOALILO-UHFFFAOYSA-N
SMILES:
OC1CCCCC1c1ccc(c(c1)F)F
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.101g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.24g/mol
Monoisotopic Mass:
212.101g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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