Nitrogen trichloride

CAS Number: 10025-85-1
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ClN(Cl)Cl
Molecule Information
Mutagenic: low Tumorigenic: none Irritant: none
Formula
NCl3
Molecular Weight
120.366
Drug-likeness
-1.7675
CAS
10025-85-1
InChI key
QEHKBHWEUPXBCW-UHFFFAOYSA-N
SMILES
ClN(Cl)Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 10025-85-1
Molecule Name Nitrogen trichloride
Molecular Formula NCl3
SMILES ClN(Cl)Cl
InChI InChI=1S/Cl3N/c1-4(2)3
InChI Key QEHKBHWEUPXBCW-UHFFFAOYSA-N
CanonicalSyTyLFy 35c0f974f0df9ea8
TotalMolweight 120.366
Molecular Weight 120.366
MonoisotopicMass 118.90963
CLogP -4.8609
CLogS -2.661
H Acceptors 1
TotalSurfaceArea 70.06
Relative PSA 0.050671
PolarSurfaceArea 3.24
Drug-likeness -1.7675
Mutagenic low
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions Cl,Br,I on N,O,P,S,Se,I
Shape Index 0.75
Fragments 1
Non HAtoms 4
NonCHAtoms 4
Electronegative Atoms 4
Sp3Atoms 1
Symmetricatoms 2

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