(2-Chlorophenyl)phosphane

CAS Number: 53772-57-9
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Pc(cccc1)c1Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C6H6ClP
Molecular Weight
144.541
Drug-likeness
-3.9251
CAS
53772-57-9
InChI key
KUXIQKVLTGHSAN-UHFFFAOYSA-N
SMILES
Pc(cccc1)c1Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 53772-57-9
Molecule Name (2-Chlorophenyl)phosphane
Molecular Formula C6H6ClP
SMILES Pc(cccc1)c1Cl
InChI InChI=1S/C6H6ClP/c7-5-3-1-2-4-6(5)8/h1-4H,8H2
InChI Key KUXIQKVLTGHSAN-UHFFFAOYSA-N
CanonicalSyTyLFy fc0009a4902d39cc
TotalMolweight 144.541
Molecular Weight 144.541
MonoisotopicMass 143.989564
CLogP 2.2681
CLogS -2.773
TotalSurfaceArea 81.93
Drug-likeness -3.9251
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.625
Molecular Complexity 0.64124
Fragments 1
Non HAtoms 8
NonCHAtoms 2
Electronegative Atoms 2
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 1

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