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1741-78-2 | Benzenamine, 2-fluoro-N-(4-methoxyphenyl)-
CAS No: 1741-78-2 Catalog No: AG001ZGR MDL No:
Product Description
Catalog Number:
AG001ZGR
Chemical Name:
Benzenamine, 2-fluoro-N-(4-methoxyphenyl)-
CAS Number:
1741-78-2
Molecular Formula:
C13H12FNO
Molecular Weight:
217.2389
IUPAC Name:
2-fluoro-N-(4-methoxyphenyl)aniline
InChI:
InChI=1S/C13H12FNO/c1-16-11-8-6-10(7-9-11)15-13-5-3-2-4-12(13)14/h2-9,15H,1H3
InChI Key:
ZGNWCEHNELRVNE-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)Nc1ccccc1F
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.243g/mol
Monoisotopic Mass:
217.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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