sodium;(4-amino-1-hydroxy-1-phosphonobutyl)-hydroxyphosphinate;trihydrate


Chemical Name: sodium;(4-amino-1-hydroxy-1-phosphonobutyl)-hydroxyphosphinate;trihydrate
CAS Number: 121268-17-5
Product Number: AG00HG2D(AGN-PC-0478ON)
Synonyms:
MDL No: MFCD01748233
Molecular Formula: C4H18NNaO10P2
Molecular Weight: 325.1237

Identification/Properties


Computed Properties
Molecular Weight:
325.122g/mol
Hydrogen Bond Donor Count:
8
Hydrogen Bond Acceptor Count:
11
Rotatable Bond Count:
5
Exact Mass:
325.03g/mol
Monoisotopic Mass:
325.03g/mol
Topological Polar Surface Area:
167A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
293
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
5
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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