Ethyl(trimethyl)phosphanium iodide

CAS Number: 3040-78-6
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CC[P+](C)(C)C.[I-]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
I.C5H14P
Molecular Weight
105.14
Drug-likeness
-12.32
CAS
3040-78-6
InChI key
YPNLZDRHOPRKDR-UHFFFAOYSA-M
SMILES
CC[P+](C)(C)C.[I-]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 3040-78-6
Molecule Name Ethyl(trimethyl)phosphanium iodide
Molecular Formula I.C5H14P
SMILES CC[P+](C)(C)C.[I-]
InChI InChI=1S/C5H14P.HI/c1-5-6(2,3)4;/h5H2,1-4H3;1H/q+1;/p-1
InChI Key YPNLZDRHOPRKDR-UHFFFAOYSA-M
CanonicalSyTyLFy a91e8fdb6f2b3b45
TotalMolweight 232.04
Molecular Weight 105.14
MonoisotopicMass 105.083312
CLogP 1.055
CLogS -2.49
TotalSurfaceArea 89.8
Drug-likeness -12.32
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions phosphonium
Shape Index 0.66667
Molecula Flexibility 0.69546
Molecular Complexity 0.69315
Fragments 2
Non HAtoms 6
NonCHAtoms 1
Electronegative Atoms 1
Rotatable Bond 1
Sp3Atoms 6
Symmetricatoms 2

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