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Home > Pyridines > 1052540-27-8
1052540-27-8 | (2S)-2-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}pyrrolidine dihydrochloride
CAS No: 1052540-27-8 Catalog No: AG019OSQ MDL No:MFCD08273541
Product Description
Catalog Number:
AG019OSQ
Chemical Name:
(2S)-2-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}pyrrolidine dihydrochloride
CAS Number:
1052540-27-8
Molecular Formula:
C10H14Cl2N4
Molecular Weight:
261.1510
MDL Number:
MFCD08273541
IUPAC Name:
3-[(2S)-pyrrolidin-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;dihydrochloride
InChI:
InChI=1S/C10H12N4.2ClH/c1-2-7-14-9(5-1)12-13-10(14)8-4-3-6-11-8;;/h1-2,5,7-8,11H,3-4,6H2;2*1H/t8-;;/m0../s1
InChI Key:
VCQKJNFGHBYGNZ-JZGIKJSDSA-N
SMILES:
C1CN[C@@H](C1)c1nnc2n1cccc2.Cl.Cl
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
260.06g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
261.15g/mol
Monoisotopic Mass:
260.06g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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