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868-16-6 | Butanedioic acid,2,3-dihydroxy- (2R,3R)-, lithium salt (1:1)
CAS No: 868-16-6 Catalog No: AG004RS5 MDL No:MFCD00152600
Product Description
Catalog Number:
AG004RS5
Chemical Name:
Butanedioic acid,2,3-dihydroxy- (2R,3R)-, lithium salt (1:1)
CAS Number:
868-16-6
Molecular Formula:
C4H5LiO6
Molecular Weight:
156.0199
MDL Number:
MFCD00152600
IUPAC Name:
dilithium;2,3-dihydroxybutanedioate
InChI:
InChI=1S/C4H6O6.2Li/c5-1(3(7)8)2(6)4(9)10;;/h1-2,5-6H,(H,7,8)(H,9,10);;/q;2*+1/p-2
InChI Key:
JCCYXJAEFHYHPP-UHFFFAOYSA-L
SMILES:
[O-]C(=O)C(C(C(=O)O)O)O.[Li+]
Properties
Complexity:
123
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.033g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
161.95g/mol
Monoisotopic Mass:
162.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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