Dichloro(imino)phosphanium

CAS Number: 14939-36-7
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N=[P+](Cl)Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HNCl2P
Molecular Weight
116.895
Drug-likeness
-5.1175
CAS
14939-36-7
InChI key
QTQOPTASXQXGFX-UHFFFAOYSA-N
SMILES
N=[P+](Cl)Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 14939-36-7
Molecule Name Dichloro(imino)phosphanium
Molecular Formula HNCl2P
SMILES N=[P+](Cl)Cl
InChI InChI=1S/Cl2HNP/c1-4(2)3/h3H/q+1
InChI Key QTQOPTASXQXGFX-UHFFFAOYSA-N
CanonicalSyTyLFy 43c9b5bbc0a1b19
TotalMolweight 116.895
Molecular Weight 116.895
MonoisotopicMass 115.922365
CLogS -1.8
H Acceptors 1
H Donors 1
TotalSurfaceArea 59.94
Relative PSA 0.26026
PolarSurfaceArea 23.85
Drug-likeness -5.1175
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions acyl-halogenide type; Cl,Br,I on
Shape Index 0.75
Fragments 1
Non HAtoms 4
NonCHAtoms 4
Electronegative Atoms 4
Sp3Atoms 1
Symmetricatoms 1

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