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1397215-65-4 | 2-Pyridinemethanamine, N-[4-methoxy-3-(trifluoromethyl)phenyl]-
CAS No: 1397215-65-4 Catalog No: AG001BLO MDL No:
Product Description
Catalog Number:
AG001BLO
Chemical Name:
2-Pyridinemethanamine, N-[4-methoxy-3-(trifluoromethyl)phenyl]-
CAS Number:
1397215-65-4
Molecular Formula:
C14H13F3N2O
Molecular Weight:
282.2610
IUPAC Name:
4-methoxy-N-(pyridin-2-ylmethyl)-3-(trifluoromethyl)aniline
InChI:
InChI=1S/C14H13F3N2O/c1-20-13-6-5-10(8-12(13)14(15,16)17)19-9-11-4-2-3-7-18-11/h2-8,19H,9H2,1H3
InChI Key:
STZOXXVMLNFLMP-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C(F)(F)F)NCc1ccccn1
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.098g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
282.266g/mol
Monoisotopic Mass:
282.098g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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