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102206-79-1 | 3,4,5-Pyridinetricarbonitrile, 2-amino-6-(methoxymethylamino)-
CAS No: 102206-79-1 Catalog No: AG0006WM MDL No:
Product Description
Catalog Number:
AG0006WM
Chemical Name:
3,4,5-Pyridinetricarbonitrile, 2-amino-6-(methoxymethylamino)-
CAS Number:
102206-79-1
Molecular Formula:
C10H8N6O
Molecular Weight:
228.2101
IUPAC Name:
2-amino-6-[methoxy(methyl)amino]pyridine-3,4,5-tricarbonitrile
InChI:
InChI=1S/C10H8N6O/c1-16(17-2)10-8(5-13)6(3-11)7(4-12)9(14)15-10/h1-2H3,(H2,14,15)
InChI Key:
WXKUOSCGHLKUGU-UHFFFAOYSA-N
SMILES:
COCNc1nc(N)c(c(c1C#N)C#N)C#N
NSC Number:
663613
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.076g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.215g/mol
Monoisotopic Mass:
228.076g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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