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822-69-5 | 1,2,4-Triazin-5-amine
CAS No: 822-69-5 Catalog No: AG005003 MDL No:MFCD19204976
Product Description
Catalog Number:
AG005003
Chemical Name:
1,2,4-Triazin-5-amine
CAS Number:
822-69-5
Molecular Formula:
C3H4N4
Molecular Weight:
96.0907
MDL Number:
MFCD19204976
IUPAC Name:
1,2,4-triazin-5-amine
InChI:
InChI=1S/C3H4N4/c4-3-1-6-7-2-5-3/h1-2H,(H2,4,5,7)
InChI Key:
XULSZEJIHQWWEB-UHFFFAOYSA-N
SMILES:
Nc1cnncn1
Properties
Complexity:
54.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
96.044g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
96.093g/mol
Monoisotopic Mass:
96.044g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
64.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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