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Phenyltrimethyl tin - Compound Summary (CID 123095)

Depositor-Supplied Synonyms: (Total: 7)
Sort:
Phenyltrimethyl tin
Trimethyl(phenyl)tin
Stannane, trimethylphenyl-
Trimethylphenylstannane
366331_ALDRICH
InChI=1/C6H5.3CH3.Sn/c1-2-4-6-5-3-1;;;;/h1-5H;3*1H3
934-56-5


Properties Computed from Structure:
Molecular Weight240.91746 [g/mol]
Molecular FormulaC9H14Sn
H-Bond Donor0
H-Bond Acceptor0
Rotatable Bond Count1
Exact Mass242.011747
MonoIsotopic Mass242.011747
Topological Polar Surface Area0
Heavy Atom Count10
Formal Charge0
Complexity95.8
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1


Descriptors Computed from Structure:
IUPAC Name: trimethyl(phenyl)stannane
Canonical SMILES: C[Sn](C)(C)C1=CC=CC=C1
InChI: InChI=1S/C6H5.3CH3.Sn/c1-2-4-6-5-3-1;;;;/h1-5H;3*1H3;
InChIKey: COHOGNZHAUOXPA-UHFFFAOYSA-N


Compound Information:
CID 123095   
Create Date: 2005-03-27


Similar Compounds: 529 Links


Substance Information:
Substances:
    All: 13 Links
    Same structure: 9 Links
    Mixture: 4 Links

Category: [for same structure substances]
Biological Properties: 1 Link
   DiscoveryGate ( 1 )
SID 10240394 - External ID: 123095

Journal Publishers: 1 Link
   Thomson Pharma ( 1 )
SID 16022539 - External ID: 01379192

Physical Properties: 3 Links
   NIST ( 1 )
SID 10456822 - External ID: 1362148505
   NIST Chemistry WebBook ( 1 )
SID 10538300 - External ID: 1362148505
   NMRShiftDB ( 1 )
SID 8003682 - External ID: 20053349

Substance Vendors: 2 Links
   ChemSpider ( 1 )
SID 29303360 - External ID: 109715
   Sigma-Aldrich ( 1 )
SID 24862644 - External ID: 366331_ALDRICH

Theoretical Properties: 1 Link
   ChemDB ( 1 )
SID 7479458 - External ID: 6685068

Toxicology: 1 Link
   ChemIDplus ( 1 )
SID 699657 - External ID: 000934565
     

2D

3D
Compound ID123095
Molecular Weight240.91746 [g/mol]
Molecular FormulaC9H14Sn
H-Bond Donor0
H-Bond Acceptor0


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