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88607-11-8 | 1,1'-Biphenyl, 3-fluoro-4-methoxy-4'-pentyl-
CAS No: 88607-11-8 Catalog No: AG004CBA MDL No:
Product Description
Catalog Number:
AG004CBA
Chemical Name:
1,1'-Biphenyl, 3-fluoro-4-methoxy-4'-pentyl-
CAS Number:
88607-11-8
Molecular Formula:
C18H21FO
Molecular Weight:
272.3571
IUPAC Name:
2-fluoro-1-methoxy-4-(4-pentylphenyl)benzene
InChI:
InChI=1S/C18H21FO/c1-3-4-5-6-14-7-9-15(10-8-14)16-11-12-18(20-2)17(19)13-16/h7-13H,3-6H2,1-2H3
InChI Key:
HFJDZNIMBVCBLT-UHFFFAOYSA-N
SMILES:
CCCCCc1ccc(cc1)c1ccc(c(c1)F)OC
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.158g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.363g/mol
Monoisotopic Mass:
272.158g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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