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866-17-1 | Butanedioic acid,2,2,3,3-tetrahydroxy-, sodium salt (1:2)
CAS No: 866-17-1 Catalog No: AG004P0D MDL No:
Product Description
Catalog Number:
AG004P0D
Chemical Name:
Butanedioic acid,2,2,3,3-tetrahydroxy-, sodium salt (1:2)
CAS Number:
866-17-1
Molecular Formula:
C4H4Na2O8
Molecular Weight:
226.0493
IUPAC Name:
disodium;2,2,3,3-tetrahydroxybutanedioate
InChI:
InChI=1S/C4H6O8.2Na/c5-1(6)3(9,10)4(11,12)2(7)8;;/h9-12H,(H,5,6)(H,7,8);;/q;2*+1/p-2
InChI Key:
JSKIAGGRMZDKAV-UHFFFAOYSA-L
SMILES:
[O-]C(=O)C(C(C(=O)[O-])(O)O)(O)O.[Na+].[Na+]
EC Number:
212-749-2
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.97g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
226.048g/mol
Monoisotopic Mass:
225.97g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
161A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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