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Home > Fluorides > 137644-51-0
137644-51-0 | 1,1'-Biphenyl, 4-(trans-4-propylcyclohexyl)-4'-(trifluoromethyl)-
CAS No: 137644-51-0 Catalog No: AG0013NL MDL No:MFCD16039345
Product Description
Catalog Number:
AG0013NL
Chemical Name:
1,1'-Biphenyl, 4-(trans-4-propylcyclohexyl)-4'-(trifluoromethyl)-
CAS Number:
137644-51-0
Molecular Formula:
C22H25F3
Molecular Weight:
346.4291
MDL Number:
MFCD16039345
IUPAC Name:
1-(4-propylcyclohexyl)-4-[4-(trifluoromethyl)phenyl]benzene
InChI:
InChI=1S/C22H25F3/c1-2-3-16-4-6-17(7-5-16)18-8-10-19(11-9-18)20-12-14-21(15-13-20)22(23,24)25/h8-17H,2-7H2,1H3
InChI Key:
XHAQVTQQTINORH-UHFFFAOYSA-N
SMILES:
CCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)c1ccc(cc1)C(F)(F)F
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.191g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
346.437g/mol
Monoisotopic Mass:
346.191g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.3
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