Phosphorimidic trichloride

CAS Number: 14700-11-9
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N=P(Cl)(Cl)Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HNCl3P
Molecular Weight
152.348
Drug-likeness
-13.827
CAS
14700-11-9
InChI key
YPPNKRMLVAEYTG-UHFFFAOYSA-N
SMILES
N=P(Cl)(Cl)Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 14700-11-9
Molecule Name Phosphorimidic trichloride
Molecular Formula HNCl3P
SMILES N=P(Cl)(Cl)Cl
InChI InChI=1S/Cl3HNP/c1-5(2,3)4/h4H
InChI Key YPPNKRMLVAEYTG-UHFFFAOYSA-N
CanonicalSyTyLFy 1ab5c13145ece6a3
TotalMolweight 152.348
Molecular Weight 152.348
MonoisotopicMass 150.891217
CLogS -2.992
H Acceptors 1
H Donors 1
TotalSurfaceArea 86.09
Relative PSA 0.22744
PolarSurfaceArea 33.66
Drug-likeness -13.827
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions acyl-halogenide type; Cl,Br,I on
Shape Index 0.6
Molecular Complexity 0.80472
Fragments 1
Non HAtoms 5
NonCHAtoms 5
Electronegative Atoms 5
Sp3Atoms 1
Symmetricatoms 2

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