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Home > Fluorides > 137528-89-3

137528-89-3

137528-89-3 | 1,1'-Biphenyl, 3,5-difluoro-4'-pentyl-

CAS No: 137528-89-3 Catalog No: AG0013HN MDL No:

Product Description

Catalog Number:
AG0013HN
Chemical Name:
1,1'-Biphenyl, 3,5-difluoro-4'-pentyl-
CAS Number:
137528-89-3
Molecular Formula:
C17H18F2
Molecular Weight:
260.3216
IUPAC Name:
1,3-difluoro-5-(4-pentylphenyl)benzene
InChI:
InChI=1S/C17H18F2/c1-2-3-4-5-13-6-8-14(9-7-13)15-10-16(18)12-17(19)11-15/h6-12H,2-5H2,1H3
InChI Key:
QCMGPUNAKTZLQT-UHFFFAOYSA-N
SMILES:
CCCCCc1ccc(cc1)c1cc(F)cc(c1)F

Properties

Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.138g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.328g/mol
Monoisotopic Mass:
260.138g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2  

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