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Home > Fluorides > 139395-95-2
139395-95-2 | 1,1'-Biphenyl, 3,4-difluoro-4'-(trans-4-heptylcyclohexyl)-
CAS No: 139395-95-2 Catalog No: AG001AXT MDL No:
Product Description
Catalog Number:
AG001AXT
Chemical Name:
1,1'-Biphenyl, 3,4-difluoro-4'-(trans-4-heptylcyclohexyl)-
CAS Number:
139395-95-2
Molecular Formula:
C25H32F2
Molecular Weight:
370.5184
IUPAC Name:
1,2-difluoro-4-[4-(4-heptylcyclohexyl)phenyl]benzene
InChI:
InChI=1S/C25H32F2/c1-2-3-4-5-6-7-19-8-10-20(11-9-19)21-12-14-22(15-13-21)23-16-17-24(26)25(27)18-23/h12-20H,2-11H2,1H3
InChI Key:
ZEYWVWKPIJUOLS-UHFFFAOYSA-N
SMILES:
CCCCCCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)c1ccc(c(c1)F)F
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.247g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
370.528g/mol
Monoisotopic Mass:
370.247g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.8
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