[(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane

C33H72OSiSn2 — CID 11018105

IUPAC[(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane
SMILESCCCC[Sn](CCCC)(CCCC)C(/C=C/O[Si](C)(C)C(C)(C)C)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C9H18OSi.6C4H9.2Sn/c1-7-8-10-11(5,6)9(2,3)4;6*1-3-4-2;;/h1,7-8H,2-6H3;6*1,3-4H2,2H3;;/b8-7+;;;;;;;;
InChIKeySHYZGEWIHNUYCJ-HORRFMSOSA-N
MW750.45 g/mol
LogP13.13
Rot. Bonds23

About [(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane

[(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane (PubChem CID 11018105) has the molecular formula C33H72OSiSn2 and a molecular weight of 750.45 g/mol. Its IUPAC name is [(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name[(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane
PubChem CID11018105
Molecular FormulaC33H72OSiSn2
Molecular Weight750.45 g/mol
Exact Mass752.34
IUPAC Name[(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane
SMILESCCCC[Sn](CCCC)(CCCC)C(/C=C/O[Si](C)(C)C(C)(C)C)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C9H18OSi.6C4H9.2Sn/c1-7-8-10-11(5,6)9(2,3)4;6*1-3-4-2;;/h1,7-8H,2-6H3;6*1,3-4H2,2H3;;/b8-7+;;;;;;;;
InChIKeySHYZGEWIHNUYCJ-HORRFMSOSA-N
XLogP13.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds23
Heavy Atoms37
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500750.45
LogP ≤ 513.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane?
The IUPAC name of [(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane (CID 11018105) is [(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane.
What is the SMILES notation for [(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane?
The canonical SMILES for [(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane is CCCC[Sn](CCCC)(CCCC)C(/C=C/O[Si](C)(C)C(C)(C)C)[Sn](CCCC)(CCCC)CCCC.
What is the InChIKey of [(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane?
The InChIKey is SHYZGEWIHNUYCJ-HORRFMSOSA-N. The full InChI is InChI=1S/C9H18OSi.6C4H9.2Sn/c1-7-8-10-11(5,6)9(2,3)4;6*1-3-4-2;;/h1,7-8H,2-6H3;6*1,3-4H2,2H3;;/b8-7+;;;;;;;;.
What are the key properties of [(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane?
[(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane has a molecular weight of 750.45 g/mol, XLogP of 13.13, 23 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-3,3-bis(tributylstannyl)prop-1-enoxy]-tert-butyl-dimethylsilane is sourced from PubChem (CID 11018105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).