tributyl(2-phenoxyethyl)stannane

C20H36OSn — CID 67611861

IUPACtributyl(2-phenoxyethyl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)CCOc1ccccc1
InChIInChI=1S/C8H9O.3C4H9.Sn/c1-2-9-8-6-4-3-5-7-8;3*1-3-4-2;/h3-7H,1-2H2;3*1,3-4H2,2H3;
InChIKeyWQHBZEVTGNUZBL-UHFFFAOYSA-N
MW411.22 g/mol
LogP6.91
Rot. Bonds13

About tributyl(2-phenoxyethyl)stannane

tributyl(2-phenoxyethyl)stannane (PubChem CID 67611861) has the molecular formula C20H36OSn and a molecular weight of 411.22 g/mol. Its IUPAC name is tributyl(2-phenoxyethyl)stannane.

Molecular Properties

Compound Nametributyl(2-phenoxyethyl)stannane
PubChem CID67611861
Molecular FormulaC20H36OSn
Molecular Weight411.22 g/mol
Exact Mass412.18
IUPAC Nametributyl(2-phenoxyethyl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)CCOc1ccccc1
InChIInChI=1S/C8H9O.3C4H9.Sn/c1-2-9-8-6-4-3-5-7-8;3*1-3-4-2;/h3-7H,1-2H2;3*1,3-4H2,2H3;
InChIKeyWQHBZEVTGNUZBL-UHFFFAOYSA-N
XLogP6.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500411.22
LogP ≤ 56.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

tributyl(2-phenoxyethyl)stannane;1,2,3-trimethylbenzene
CID 67611860
pentoxybenzene;undecane
CID 174778179
CID 161224902
CID 161224902
azane;propoxybenzene
CID 66667480
ethene;nonoxybenzene;sulfane
CID 174919596
acetic acid;butoxybenzene
CID 162338086
dodecoxybenzene;ethene;hydrate
CID 174804981
1-butyl-3,5-bis(2-phenoxyethyl)benzene
CID 174735966
2-pentoxyethoxybenzene
CID 54431229
dibutyl(3-phenoxypropyl)azanium
CID 140631674
butoxybenzene;propanal
CID 174367271
1,4-dibutoxybenzene;phenol
CID 174756360

Frequently Asked Questions

What is the IUPAC name of tributyl(2-phenoxyethyl)stannane?
The IUPAC name of tributyl(2-phenoxyethyl)stannane (CID 67611861) is tributyl(2-phenoxyethyl)stannane.
What is the SMILES notation for tributyl(2-phenoxyethyl)stannane?
The canonical SMILES for tributyl(2-phenoxyethyl)stannane is CCCC[Sn](CCCC)(CCCC)CCOc1ccccc1.
What is the InChIKey of tributyl(2-phenoxyethyl)stannane?
The InChIKey is WQHBZEVTGNUZBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9O.3C4H9.Sn/c1-2-9-8-6-4-3-5-7-8;3*1-3-4-2;/h3-7H,1-2H2;3*1,3-4H2,2H3;.
What are the key properties of tributyl(2-phenoxyethyl)stannane?
tributyl(2-phenoxyethyl)stannane has a molecular weight of 411.22 g/mol, XLogP of 6.91, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(2-phenoxyethyl)stannane is sourced from PubChem (CID 67611861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).