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1261591-62-1

1261591-62-1 | 4-Pyridinamine, 3-[3-(trifluoromethyl)phenyl]-

CAS No: 1261591-62-1 Catalog No: AG000RVP MDL No:

Product Description

Catalog Number:
AG000RVP
Chemical Name:
4-Pyridinamine, 3-[3-(trifluoromethyl)phenyl]-
CAS Number:
1261591-62-1
Molecular Formula:
C12H9F3N2
Molecular Weight:
238.2085
IUPAC Name:
3-[3-(trifluoromethyl)phenyl]pyridin-4-amine
InChI:
InChI=1S/C12H9F3N2/c13-12(14,15)9-3-1-2-8(6-9)10-7-17-5-4-11(10)16/h1-7H,(H2,16,17)
InChI Key:
CHRAELMJXLIMJQ-UHFFFAOYSA-N
SMILES:
Nc1ccncc1c1cccc(c1)C(F)(F)F

Properties

Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.072g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
238.213g/mol
Monoisotopic Mass:
238.072g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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