tert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane

C22H48OSiSn — CID 10435063

IUPACtert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane
SMILESCCCC[Sn](/C=C/CCO[Si](C)(C)C(C)(C)C)(CCCC)CCCC
InChIInChI=1S/C10H21OSi.3C4H9.Sn/c1-7-8-9-11-12(5,6)10(2,3)4;3*1-3-4-2;/h1,7H,8-9H2,2-6H3;3*1,3-4H2,2H3;
InChIKeyHCTXCRZDTOQVBO-UHFFFAOYSA-N
MW475.42 g/mol
LogP8.34
Rot. Bonds14

About tert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane

tert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane (PubChem CID 10435063) has the molecular formula C22H48OSiSn and a molecular weight of 475.42 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane
PubChem CID10435063
Molecular FormulaC22H48OSiSn
Molecular Weight475.42 g/mol
Exact Mass476.25
IUPAC Nametert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane
SMILESCCCC[Sn](/C=C/CCO[Si](C)(C)C(C)(C)C)(CCCC)CCCC
InChIInChI=1S/C10H21OSi.3C4H9.Sn/c1-7-8-9-11-12(5,6)10(2,3)4;3*1-3-4-2;/h1,7H,8-9H2,2-6H3;3*1,3-4H2,2H3;
InChIKeyHCTXCRZDTOQVBO-UHFFFAOYSA-N
XLogP8.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500475.42
LogP ≤ 58.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane (CID 10435063) is tert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane is CCCC[Sn](/C=C/CCO[Si](C)(C)C(C)(C)C)(CCCC)CCCC.
What is the InChIKey of tert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane?
The InChIKey is HCTXCRZDTOQVBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21OSi.3C4H9.Sn/c1-7-8-9-11-12(5,6)10(2,3)4;3*1-3-4-2;/h1,7H,8-9H2,2-6H3;3*1,3-4H2,2H3;.
What are the key properties of tert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane?
tert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane has a molecular weight of 475.42 g/mol, XLogP of 8.34, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(E)-4-tributylstannylbut-3-enoxy]silane is sourced from PubChem (CID 10435063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).