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1195625-75-2 | 1,2,4-Triazolo[4,3-a]pyrimidin-3-amine
CAS No: 1195625-75-2 Catalog No: AG000P81 MDL No:MFCD17677032
Product Description
Catalog Number:
AG000P81
Chemical Name:
1,2,4-Triazolo[4,3-a]pyrimidin-3-amine
CAS Number:
1195625-75-2
Molecular Formula:
C5H5N5
Molecular Weight:
135.1267
MDL Number:
MFCD17677032
IUPAC Name:
[1,2,4]triazolo[4,3-a]pyrimidin-3-amine
InChI:
InChI=1S/C5H5N5/c6-4-8-9-5-7-2-1-3-10(4)5/h1-3H,(H2,6,8)
InChI Key:
GSOHZHFIJOTFHI-UHFFFAOYSA-N
SMILES:
Nc1nnc2n1cccn2
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.054g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
135.13g/mol
Monoisotopic Mass:
135.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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