Home Other Building Blocks 1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanamine;dihydrochloride

1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanamine;dihydrochloride

CAS No.:
1052543-81-3
Catalog Number:
AG019EV4
Molecular Formula:
C8H12Cl2N4
Molecular Weight:
235.1137
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Product Description
Catalog Number:
AG019EV4
Chemical Name:
1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanamine;dihydrochloride
CAS Number:
1052543-81-3
Molecular Formula:
C8H12Cl2N4
Molecular Weight:
235.1137
MDL Number:
MFCD07685901
IUPAC Name:
1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanamine;dihydrochloride
InChI:
InChI=1S/C8H10N4.2ClH/c1-6(9)8-11-10-7-4-2-3-5-12(7)8;;/h2-6H,9H2,1H3;2*1H
InChI Key:
YKPQHXMMWLRNHY-UHFFFAOYSA-N
SMILES:
CC(c1nnc2n1cccc2)N.Cl.Cl
Properties
Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.044g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
235.112g/mol
Monoisotopic Mass:
234.044g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties