trimethyl(octadecyl)stannane

C21H46Sn — CID 154056481

IUPACtrimethyl(octadecyl)stannane
SMILESCCCCCCCCCCCCCCCCCC[Sn](C)(C)C
InChIInChI=1S/C18H37.3CH3.Sn/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2;;;;/h1,3-18H2,2H3;3*1H3;
InChIKeyNLSBDCZBKABABN-UHFFFAOYSA-N
MW417.31 g/mol
LogP8.59
Rot. Bonds17

About trimethyl(octadecyl)stannane

trimethyl(octadecyl)stannane (PubChem CID 154056481) has the molecular formula C21H46Sn and a molecular weight of 417.31 g/mol. Its IUPAC name is trimethyl(octadecyl)stannane.

Molecular Properties

Compound Nametrimethyl(octadecyl)stannane
PubChem CID154056481
Molecular FormulaC21H46Sn
Molecular Weight417.31 g/mol
Exact Mass418.26
IUPAC Nametrimethyl(octadecyl)stannane
SMILESCCCCCCCCCCCCCCCCCC[Sn](C)(C)C
InChIInChI=1S/C18H37.3CH3.Sn/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2;;;;/h1,3-18H2,2H3;3*1H3;
InChIKeyNLSBDCZBKABABN-UHFFFAOYSA-N
XLogP8.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds17
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500417.31
LogP ≤ 58.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

dihexyl(dimethyl)stannane
CID 86221007
methyl(trioctadecyl)stannane
CID 154048335
diheptyl(dioctyl)stannane
CID 152736724
tributyl(hexadecyl)stannane
CID 174658060
hexacosane;octacosane
CID 158944700
bis(decane);hexane
CID 158666782
decane;heptane
CID 159049036
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649
CID 161246447
CID 161246447
triacontane
CID 12535
dictane
CID 19848341

Frequently Asked Questions

What is the IUPAC name of trimethyl(octadecyl)stannane?
The IUPAC name of trimethyl(octadecyl)stannane (CID 154056481) is trimethyl(octadecyl)stannane.
What is the SMILES notation for trimethyl(octadecyl)stannane?
The canonical SMILES for trimethyl(octadecyl)stannane is CCCCCCCCCCCCCCCCCC[Sn](C)(C)C.
What is the InChIKey of trimethyl(octadecyl)stannane?
The InChIKey is NLSBDCZBKABABN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37.3CH3.Sn/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2;;;;/h1,3-18H2,2H3;3*1H3;.
What are the key properties of trimethyl(octadecyl)stannane?
trimethyl(octadecyl)stannane has a molecular weight of 417.31 g/mol, XLogP of 8.59, 17 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(octadecyl)stannane is sourced from PubChem (CID 154056481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).