methanolate;tributylstannanylium

C13H30OSn — CID 11964040

IUPACmethanolate;tributylstannanylium
SMILESCCCC[Sn+](CCCC)CCCC.C[O-]
InChIInChI=1S/3C4H9.CH3O.Sn/c3*1-3-4-2;1-2;/h3*1,3-4H2,2H3;1H3;/q;;;-1;+1
InChIKeyKJGLZJQPMKQFIK-UHFFFAOYSA-N
MW321.09 g/mol
LogP3.86
Rot. Bonds9

About methanolate;tributylstannanylium

methanolate;tributylstannanylium (PubChem CID 11964040) has the molecular formula C13H30OSn and a molecular weight of 321.09 g/mol. Its IUPAC name is methanolate;tributylstannanylium.

Molecular Properties

Compound Namemethanolate;tributylstannanylium
PubChem CID11964040
Molecular FormulaC13H30OSn
Molecular Weight321.09 g/mol
Exact Mass322.13
IUPAC Namemethanolate;tributylstannanylium
SMILESCCCC[Sn+](CCCC)CCCC.C[O-]
InChIInChI=1S/3C4H9.CH3O.Sn/c3*1-3-4-2;1-2;/h3*1,3-4H2,2H3;1H3;/q;;;-1;+1
InChIKeyKJGLZJQPMKQFIK-UHFFFAOYSA-N
XLogP3.86
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.09
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of methanolate;tributylstannanylium?
The IUPAC name of methanolate;tributylstannanylium (CID 11964040) is methanolate;tributylstannanylium.
What is the SMILES notation for methanolate;tributylstannanylium?
The canonical SMILES for methanolate;tributylstannanylium is CCCC[Sn+](CCCC)CCCC.C[O-].
What is the InChIKey of methanolate;tributylstannanylium?
The InChIKey is KJGLZJQPMKQFIK-UHFFFAOYSA-N. The full InChI is InChI=1S/3C4H9.CH3O.Sn/c3*1-3-4-2;1-2;/h3*1,3-4H2,2H3;1H3;/q;;;-1;+1.
What are the key properties of methanolate;tributylstannanylium?
methanolate;tributylstannanylium has a molecular weight of 321.09 g/mol, XLogP of 3.86, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methanolate;tributylstannanylium is sourced from PubChem (CID 11964040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).