Home Halogens {8-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}methanamine dihydrochloride

{8-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}methanamine dihydrochloride

CAS No.:
2031269-53-9
Catalog Number:
AG01B7BE
Molecular Formula:
C7H9Cl3N4
Molecular Weight:
255.5322
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Product Description
Catalog Number:
AG01B7BE
Chemical Name:
{8-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl}methanamine dihydrochloride
CAS Number:
2031269-53-9
Molecular Formula:
C7H9Cl3N4
Molecular Weight:
255.5322
MDL Number:
MFCD30345238
IUPAC Name:
(8-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine;dihydrochloride
InChI:
InChI=1S/C7H7ClN4.2ClH/c8-5-2-1-3-12-6(4-9)10-11-7(5)12;;/h1-3H,4,9H2;2*1H
InChI Key:
WRFCJKAXGQTGSV-UHFFFAOYSA-N
SMILES:
NCc1nnc2n1cccc2Cl.Cl.Cl
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.989g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
255.527g/mol
Monoisotopic Mass:
253.989g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties