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81618-22-6 | Phosphonic acid, (5-hydroxy-2-oxo-4-imidazolidinyl)-, dimethyl ester
CAS No: 81618-22-6 Catalog No: AG0058E0 MDL No:
Product Description
Catalog Number:
AG0058E0
Chemical Name:
Phosphonic acid, (5-hydroxy-2-oxo-4-imidazolidinyl)-, dimethyl ester
CAS Number:
81618-22-6
Molecular Formula:
C5H11N2O5P
Molecular Weight:
210.1250
IUPAC Name:
4-dimethoxyphosphoryl-5-hydroxyimidazolidin-2-one
InChI:
InChI=1S/C5H11N2O5P/c1-11-13(10,12-2)4-3(8)6-5(9)7-4/h3-4,8H,1-2H3,(H2,6,7,9)
InChI Key:
BXVYXQREERNQBZ-UHFFFAOYSA-N
SMILES:
COP(=O)(C1NC(=O)NC1O)OC
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.041g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
210.126g/mol
Monoisotopic Mass:
210.041g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
96.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.4
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