Butanoic acid, 2,3,4-trihydroxy-, calcium salt (2:1), (2R,3S)-


Chemical Name: Butanoic acid, 2,3,4-trihydroxy-, calcium salt (2:1), (2R,3S)-
CAS Number: 70753-61-6
Product Number: AG00IC3L(AGN-PC-0TYHDX)
Synonyms:
MDL No:
Molecular Formula: C8H14CaO10
Molecular Weight: 310.2688

Identification/Properties


Computed Properties
Molecular Weight:
310.268g/mol
Hydrogen Bond Donor Count:
6
Hydrogen Bond Acceptor Count:
10
Rotatable Bond Count:
4
Exact Mass:
310.021g/mol
Monoisotopic Mass:
310.021g/mol
Topological Polar Surface Area:
202A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
95.6
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
3
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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