(2,2-Dimethylpropyl)phosphane

CAS Number: 54772-70-2
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CC(C)(C)CP
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C5H13P
Molecular Weight
104.132
Drug-likeness
-7.2982
CAS
54772-70-2
InChI key
HJPQKYUERLEXPG-UHFFFAOYSA-N
SMILES
CC(C)(C)CP
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 54772-70-2
Molecule Name (2,2-Dimethylpropyl)phosphane
Molecular Formula C5H13P
SMILES CC(C)(C)CP
InChI InChI=1S/C5H13P/c1-5(2,3)4-6/h4,6H2,1-3H3
InChI Key HJPQKYUERLEXPG-UHFFFAOYSA-N
CanonicalSyTyLFy c9f1674a97654806
TotalMolweight 104.132
Molecular Weight 104.132
MonoisotopicMass 104.075487
CLogP 1.875
CLogS -1.801
TotalSurfaceArea 67.7
Drug-likeness -7.2982
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.66667
Molecula Flexibility 0.68141
Molecular Complexity 0.69315
Fragments 1
Non HAtoms 6
NonCHAtoms 1
Electronegative Atoms 1
Rotatable Bond 1
Sp3Atoms 6
Symmetricatoms 2

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