tert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane

C22H46OSiSn — CID 134884988

IUPACtert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane
SMILESC=C=C(CO[Si](C)(C)C(C)(C)C)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C10H19OSi.3C4H9.Sn/c1-7-8-9-11-12(5,6)10(2,3)4;3*1-3-4-2;/h1,9H2,2-6H3;3*1,3-4H2,2H3;
InChIKeyQHVZHAJYGIQYPT-UHFFFAOYSA-N
MW473.41 g/mol
LogP8.11
Rot. Bonds13

About tert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane

tert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane (PubChem CID 134884988) has the molecular formula C22H46OSiSn and a molecular weight of 473.41 g/mol. Its IUPAC name is tert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane
PubChem CID134884988
Molecular FormulaC22H46OSiSn
Molecular Weight473.41 g/mol
Exact Mass474.23
IUPAC Nametert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane
SMILESC=C=C(CO[Si](C)(C)C(C)(C)C)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C10H19OSi.3C4H9.Sn/c1-7-8-9-11-12(5,6)10(2,3)4;3*1-3-4-2;/h1,9H2,2-6H3;3*1,3-4H2,2H3;
InChIKeyQHVZHAJYGIQYPT-UHFFFAOYSA-N
XLogP8.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500473.41
LogP ≤ 58.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane?
The IUPAC name of tert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane (CID 134884988) is tert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane is C=C=C(CO[Si](C)(C)C(C)(C)C)[Sn](CCCC)(CCCC)CCCC.
What is the InChIKey of tert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane?
The InChIKey is QHVZHAJYGIQYPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19OSi.3C4H9.Sn/c1-7-8-9-11-12(5,6)10(2,3)4;3*1-3-4-2;/h1,9H2,2-6H3;3*1,3-4H2,2H3;.
What are the key properties of tert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane?
tert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane has a molecular weight of 473.41 g/mol, XLogP of 8.11, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(2-tributylstannylbuta-2,3-dienoxy)silane is sourced from PubChem (CID 134884988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).