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Molecule
ID:64301
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₁₆H₃₄Sn
Molecular Mass
345.14216
Exact Mass
346.16824509
Charge
0
InChI
InChI=1S/C4H7.3C4H9.Sn/c1-4(2)3;3*1-3-4-2;/h1H,2-3H3;3*1,3-4H2,2H3;
InChIKey
LWNCDBSQZPDFOG-UHFFFAOYSA-N
Canonic Smiles
CCCC[Sn](C=C(C)C)(CCCC)CCCC
Isomeric Smiles
C(=C(C)C)[Sn](CCCC)(CCCC)CCCC
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
7.6144
LogD (pH = 7.4)
7.6144
Log P
7.6144
Molar Refractivity
77.8535
Polarizability
35.246895
Polar Surface Area
0.0
Rotatable Bonds
10
Lipinski's Rule of Five
false
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Molecule Details
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Data Source
Commercial Catalog
Apollo Scientific
OR15613
Matrix Scientific
069627
Academic Data
PubChem
11759721
Names and Identifiers
Synonyms
(2-Methylprop-1-en-1-yl)tributylstannane
2-Methyl-1-(tributylstannyl)prop-1-ene
2-Methylpropene-1-tributylstannane
IUPAC name
tributyl(2-methylprop-1-en-1-yl)stannane
IUPAC Traditional name
tributyl(2-methylprop-1-en-1-yl)stannane
Registration numbers
MDL Number
MFCD09750019
CAS Number
66680-86-2
PubChem CID
11759721
PubChem SID
162030040
Properties
Safety Information
TSCA Listed
false
Source
Storage Warning
IRRITANT
Source
Toxic/Keep Cold
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MSDS Link
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Product Information
Purity
96%
Source
References
PubChem Literature
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Bioactivity
PubChem BioAssay