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22457-55-2 | 3-PHOSPHO-D-GLYCERIC ACID BARIUM SALT
CAS No: 22457-55-2 Catalog No: AG003JW0 MDL No:MFCD09037352
Product Description
Catalog Number:
AG003JW0
Chemical Name:
3-PHOSPHO-D-GLYCERIC ACID BARIUM SALT
CAS Number:
22457-55-2
MDL Number:
MFCD09037352
IUPAC Name:
barium(2+);[(2R)-2-carboxy-2-hydroxyethyl] phosphate;dihydrate
InChI:
InChI=1S/C3H7O7P.Ba.2H2O/c4-2(3(5)6)1-10-11(7,8)9;;;/h2,4H,1H2,(H,5,6)(H2,7,8,9);;2*1H2/q;+2;;/p-2/t2-;;;/m1.../s1
InChI Key:
IRPUBTOBTBTBNU-QYUNTSNKSA-L
EC Number:
245-012-9
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
357.904g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
357.397g/mol
Monoisotopic Mass:
357.904g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
132A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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