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1319-69-3 | 1,2,3-Propanetriol, mono(dihydrogen phosphate), potassium salt (1:2)
CAS No: 1319-69-3 Catalog No: AG000ZWF MDL No:MFCD00050730
Product Description
Catalog Number:
AG000ZWF
Chemical Name:
1,2,3-Propanetriol, mono(dihydrogen phosphate), potassium salt (1:2)
CAS Number:
1319-69-3
Molecular Formula:
C3H7K2O6P
Molecular Weight:
248.2544
MDL Number:
MFCD00050730
IUPAC Name:
dipotassium;2,3-dihydroxypropyl phosphate
InChI:
InChI=1S/C3H9O6P.2K/c4-1-3(5)2-9-10(6,7)8;;/h3-5H,1-2H2,(H2,6,7,8);;/q;2*+1/p-2
InChI Key:
CHFUHGDBYUITQJ-UHFFFAOYSA-L
SMILES:
OCC(COP(=O)([O-])[O-])O.[K+].[K+]
Properties
Complexity:
117
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.925g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
248.253g/mol
Monoisotopic Mass:
247.925g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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