Dipotassium decyl phosphate

CAS Number: 84070-00-8
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CCCCCCCCCCOP([O-])([O-])=O.[K+].[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.K.C10H21O4P
Molecular Weight
236.247
Drug-likeness
-44.601
CAS
84070-00-8
InChI key
WZPRPGQIPUCXQE-UHFFFAOYSA-L
SMILES
CCCCCCCCCCOP([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 84070-00-8
Molecule Name Dipotassium decyl phosphate
Molecular Formula K.K.C10H21O4P
SMILES CCCCCCCCCCOP([O-])([O-])=O.[K+].[K+]
InChI InChI=1S/C10H23O4P.2K/c1-2-3-4-5-6-7-8-9-10-14-15(11,12)13;;/h2-10H2,1H3,(H2,11,12,13);;/q;2*+1/p-2
InChI Key WZPRPGQIPUCXQE-UHFFFAOYSA-L
CanonicalSyTyLFy a1ee1be078e46200
TotalMolweight 314.443
Molecular Weight 236.247
MonoisotopicMass 236.117747
CLogP -2.0533
CLogS -1.057
H Acceptors 4
TotalSurfaceArea 198.43
Relative PSA 0.2801
PolarSurfaceArea 82.23
Drug-likeness -44.601
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.86667
Molecula Flexibility 0.60948
Molecular Complexity 0.32894
Fragments 3
Non HAtoms 15
NonCHAtoms 5
Electronegative Atoms 5
Rotatable Bond 10
Sp3Atoms 14
Symmetricatoms 1
AcidicOxygens 2

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