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161091-50-5 | 2,3-Pyridinediamine, N3,5,6-trimethyl-
CAS No: 161091-50-5 Catalog No: AG001S5H MDL No:
Product Description
Catalog Number:
AG001S5H
Chemical Name:
2,3-Pyridinediamine, N3,5,6-trimethyl-
CAS Number:
161091-50-5
Molecular Formula:
C8H13N3
Molecular Weight:
151.2089
IUPAC Name:
3-N,5,6-trimethylpyridine-2,3-diamine
InChI:
InChI=1S/C8H13N3/c1-5-4-7(10-3)8(9)11-6(5)2/h4,10H,1-3H3,(H2,9,11)
InChI Key:
BAGNHJHCCOWUDL-UHFFFAOYSA-N
SMILES:
CNc1cc(C)c(nc1N)C
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.111g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
151.213g/mol
Monoisotopic Mass:
151.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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