Potassium 2-glycerophosphate

CAS Number: 74493-87-1
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[O-]P([O-])(OC(CO)CO)=O.[K+].[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.K.C3H7O6P
Molecular Weight
170.057
Drug-likeness
-23.15
CAS
74493-87-1
InChI key
KOJMAGAPHTUHAC-UHFFFAOYSA-L
SMILES
[O-]P([O-])(OC(CO)CO)=O.[K+].[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 74493-87-1
Molecule Name Potassium 2-glycerophosphate
Molecular Formula K.K.C3H7O6P
SMILES [O-]P([O-])(OC(CO)CO)=O.[K+].[K+]
InChI InChI=1S/C3H9O6P.2K/c4-1-3(2-5)9-10(6,7)8;;/h3-5H,1-2H2,(H2,6,7,8);;/q;2*+1/p-2
InChI Key KOJMAGAPHTUHAC-UHFFFAOYSA-L
CanonicalSyTyLFy bea04cdd533587ef
TotalMolweight 248.253
Molecular Weight 170.057
MonoisotopicMass 169.998027
CLogP -7.1826
CLogS 1.739
H Acceptors 6
H Donors 2
TotalSurfaceArea 115.05
Relative PSA 0.71082
PolarSurfaceArea 122.69
Drug-likeness -23.15
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.6
Molecula Flexibility 0.71815
Molecular Complexity 0.54931
Fragments 3
Non HAtoms 10
NonCHAtoms 7
Electronegative Atoms 7
Rotatable Bond 4
Sp3Atoms 9
Symmetricatoms 3
AcidicOxygens 2

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