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81793-59-1 | 1,1'-Biphenyl, 4-fluoro-4'-(trans-4-pentylcyclohexyl)-
CAS No: 81793-59-1 Catalog No: AG0050M9 MDL No:
Product Description
Catalog Number:
AG0050M9
Chemical Name:
1,1'-Biphenyl, 4-fluoro-4'-(trans-4-pentylcyclohexyl)-
CAS Number:
81793-59-1
Molecular Formula:
C23H29F
Molecular Weight:
324.4748
IUPAC Name:
1-fluoro-4-[4-(4-pentylcyclohexyl)phenyl]benzene
InChI:
InChI=1S/C23H29F/c1-2-3-4-5-18-6-8-19(9-7-18)20-10-12-21(13-11-20)22-14-16-23(24)17-15-22/h10-19H,2-9H2,1H3
InChI Key:
GIXAVGROVIRVPE-UHFFFAOYSA-N
SMILES:
CCCCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)c1ccc(cc1)F
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.225g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
324.483g/mol
Monoisotopic Mass:
324.225g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.6
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