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Home > Fluorides > 1365272-56-5
1365272-56-5 | [1,1'-Biphenyl]-3-carbonitrile, 5'-fluoro-2'-methoxy-
CAS No: 1365272-56-5 Catalog No: AG00121E MDL No:MFCD21609600
Product Description
Catalog Number:
AG00121E
Chemical Name:
[1,1'-Biphenyl]-3-carbonitrile, 5'-fluoro-2'-methoxy-
CAS Number:
1365272-56-5
Molecular Formula:
C14H10FNO
Molecular Weight:
227.2337
MDL Number:
MFCD21609600
IUPAC Name:
3-(5-fluoro-2-methoxyphenyl)benzonitrile
InChI:
InChI=1S/C14H10FNO/c1-17-14-6-5-12(15)8-13(14)11-4-2-3-10(7-11)9-16/h2-8H,1H3
InChI Key:
IMWQMJHDSLAUSV-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1c1cccc(c1)C#N)F
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.075g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.238g/mol
Monoisotopic Mass:
227.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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