3-hydroxy-8-methyl-3-oxo-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridin-9-ol


Chemical Name: 3-hydroxy-8-methyl-3-oxo-1,5-dihydro-[1,3,2]dioxaphosphepino[5,6-c]pyridin-9-ol
CAS Number: 14141-47-0
Product Number: AG007ZEI(AGN-PC-0L2WVE)
Synonyms:
MDL No:
Molecular Formula: C8H10NO5P
Molecular Weight: 231.1425

Identification/Properties


Computed Properties
Molecular Weight:
231.144g/mol
XLogP3:
-1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
0
Exact Mass:
231.03g/mol
Monoisotopic Mass:
231.03g/mol
Topological Polar Surface Area:
88.9A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
286
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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