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88607-03-8 | 1,1'-Biphenyl, 4-ethoxy-3-fluoro-4'-pentyl-
CAS No: 88607-03-8 Catalog No: AG004AT4 MDL No:
Product Description
Catalog Number:
AG004AT4
Chemical Name:
1,1'-Biphenyl, 4-ethoxy-3-fluoro-4'-pentyl-
CAS Number:
88607-03-8
Molecular Formula:
C19H23FO
Molecular Weight:
286.3837
IUPAC Name:
1-ethoxy-2-fluoro-4-(4-pentylphenyl)benzene
InChI:
InChI=1S/C19H23FO/c1-3-5-6-7-15-8-10-16(11-9-15)17-12-13-19(21-4-2)18(20)14-17/h8-14H,3-7H2,1-2H3
InChI Key:
XFZZEYXXXKAFDU-UHFFFAOYSA-N
SMILES:
CCCCCc1ccc(cc1)c1ccc(c(c1)F)OCC
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.173g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.39g/mol
Monoisotopic Mass:
286.173g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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