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1245915-89-2

1245915-89-2 | 3-Pyridinemethanamine, 6-chloro-5-(trifluoromethyl)-

CAS No: 1245915-89-2 Catalog No: AG000MFS MDL No:

Product Description

Catalog Number:
AG000MFS
Chemical Name:
3-Pyridinemethanamine, 6-chloro-5-(trifluoromethyl)-
CAS Number:
1245915-89-2
Molecular Formula:
C7H6ClF3N2
Molecular Weight:
210.5841
IUPAC Name:
[6-chloro-5-(trifluoromethyl)pyridin-3-yl]methanamine
InChI:
InChI=1S/C7H6ClF3N2/c8-6-5(7(9,10)11)1-4(2-12)3-13-6/h1,3H,2,12H2
InChI Key:
YHPFQGOGRQGILK-UHFFFAOYSA-N
SMILES:
NCc1cnc(c(c1)C(F)(F)F)Cl

Properties

Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.017g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
210.584g/mol
Monoisotopic Mass:
210.017g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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