Potassium tartrate

CAS Number: 921-53-9
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[O-]C([C@@H]([C@H](C([O-])=O)O)O)=O.[K+].[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.K.C4H4O6
Molecular Weight
148.07
Drug-likeness
0.66361
CAS
921-53-9
InChI key
AVTYONGGKAJVTE-OLXYHTOASA-L
SMILES
[O-]C([C@@H]([C@H](C([O-])=O)O)O)=O.[K+].[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 921-53-9
Molecule Name Potassium tartrate
Molecular Formula K.K.C4H4O6
SMILES [O-]C([C@@H]([C@H](C([O-])=O)O)O)=O.[K+].[K+]
InChI InChI=1S/C4H6O6.2K/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/t1-,2-;;/m1../s1
InChI Key AVTYONGGKAJVTE-OLXYHTOASA-L
CanonicalSyTyLFy 8eba6d5e54063437
TotalMolweight 226.266
Molecular Weight 148.07
MonoisotopicMass 148.00079
CLogP -6.8622
CLogS 0.324
H Acceptors 6
H Donors 2
TotalSurfaceArea 101.76
Relative PSA 0.79442
PolarSurfaceArea 120.72
Drug-likeness 0.66361
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.6
Molecula Flexibility 0.59407
Molecular Complexity 0.74893
Fragments 3
Non HAtoms 10
NonCHAtoms 6
Electronegative Atoms 6
StereoCenters 2
Rotatable Bond 3
Sp3Atoms 6
Symmetricatoms 5
AcidicOxygens 2
StereoCon this enantiomer

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