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869856-82-6 | 2-Pyridinamine, 5-methyl-, phosphate (1:1)
CAS No: 869856-82-6 Catalog No: AG004KSZ MDL No:
Product Description
Catalog Number:
AG004KSZ
Chemical Name:
2-Pyridinamine, 5-methyl-, phosphate (1:1)
CAS Number:
869856-82-6
Molecular Formula:
C6H11N2O4P
Molecular Weight:
206.1363
IUPAC Name:
5-methylpyridin-2-amine;phosphoric acid
InChI:
InChI=1S/C6H8N2.H3O4P/c1-5-2-3-6(7)8-4-5;1-5(2,3)4/h2-4H,1H3,(H2,7,8);(H3,1,2,3,4)
InChI Key:
JYLHSSJLPSNJCY-UHFFFAOYSA-N
SMILES:
OP(=O)(O)O.Nc1ccc(cn1)C
Properties
Complexity:
123
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.046g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
206.138g/mol
Monoisotopic Mass:
206.046g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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