tert-Butylphosphane--hydrogen chloride (1/1)

CAS Number: 106941-18-8
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CC(C)(C)P.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HCl.C4H11P
Molecular Weight
90.1053
Drug-likeness
-6.3341
CAS
106941-18-8
InChI key
JFVASGNYLSJKCR-UHFFFAOYSA-N
SMILES
CC(C)(C)P.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 106941-18-8
Molecule Name tert-Butylphosphane--hydrogen chloride (1/1)
Molecular Formula HCl.C4H11P
SMILES CC(C)(C)P.Cl
InChI InChI=1S/C4H11P.ClH/c1-4(2,3)5;/h5H2,1-3H3;1H
InChI Key JFVASGNYLSJKCR-UHFFFAOYSA-N
CanonicalSyTyLFy 6247a5737ef78c11
TotalMolweight 126.566
Molecular Weight 90.1053
MonoisotopicMass 90.059837
CLogP 1.4286
CLogS -1.572
TotalSurfaceArea 53.94
Drug-likeness -6.3341
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.6
Molecular Complexity 0.54931
Fragments 2
Non HAtoms 5
NonCHAtoms 1
Electronegative Atoms 1
Sp3Atoms 5
Symmetricatoms 2

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