[(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane

C22H44OSiSn — CID 11454222

IUPAC[(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane
SMILESCCCC[Sn](/C=C/[C@@H](CC#C[Si](C)(C)C)OC)(CCCC)CCCC
InChIInChI=1S/C10H17OSi.3C4H9.Sn/c1-6-10(11-2)8-7-9-12(3,4)5;3*1-3-4-2;/h1,6,10H,8H2,2-5H3;3*1,3-4H2,2H3;/t10-;;;;/m0..../s1
InChIKeyIYGJYGAWQOCAIC-CZEDPBFNSA-N
MW471.39 g/mol
LogP7.22
Rot. Bonds13

About [(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane

[(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane (PubChem CID 11454222) has the molecular formula C22H44OSiSn and a molecular weight of 471.39 g/mol. Its IUPAC name is [(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane.

Molecular Properties

Compound Name[(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane
PubChem CID11454222
Molecular FormulaC22H44OSiSn
Molecular Weight471.39 g/mol
Exact Mass472.22
IUPAC Name[(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane
SMILESCCCC[Sn](/C=C/[C@@H](CC#C[Si](C)(C)C)OC)(CCCC)CCCC
InChIInChI=1S/C10H17OSi.3C4H9.Sn/c1-6-10(11-2)8-7-9-12(3,4)5;3*1-3-4-2;/h1,6,10H,8H2,2-5H3;3*1,3-4H2,2H3;/t10-;;;;/m0..../s1
InChIKeyIYGJYGAWQOCAIC-CZEDPBFNSA-N
XLogP7.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500471.39
LogP ≤ 57.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-Ethenoxypent-4-en-1-ynyl(trimethyl)silane
CID 10888537
[(E,4R)-6-iodo-4-methoxyhex-5-en-1-ynyl]-trimethylsilane
CID 173554660
Trimethyl-[3-(tributylstannylmethoxy)but-1-en-2-yl]silane
CID 177508974
trimethyl-[(E)-3-prop-2-enoxy-2-tributylstannylbut-1-enyl]silane
CID 177516670
trimethyl-[(E)-3-[(Z)-prop-1-enoxy]-2-tributylstannylbut-1-enyl]silane
CID 177545447

Frequently Asked Questions

What is the IUPAC name of [(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane?
The IUPAC name of [(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane (CID 11454222) is [(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane.
What is the SMILES notation for [(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane?
The canonical SMILES for [(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane is CCCC[Sn](/C=C/[C@@H](CC#C[Si](C)(C)C)OC)(CCCC)CCCC.
What is the InChIKey of [(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane?
The InChIKey is IYGJYGAWQOCAIC-CZEDPBFNSA-N. The full InChI is InChI=1S/C10H17OSi.3C4H9.Sn/c1-6-10(11-2)8-7-9-12(3,4)5;3*1-3-4-2;/h1,6,10H,8H2,2-5H3;3*1,3-4H2,2H3;/t10-;;;;/m0..../s1.
What are the key properties of [(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane?
[(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane has a molecular weight of 471.39 g/mol, XLogP of 7.22, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E,4R)-4-methoxy-6-tributylstannylhex-5-en-1-ynyl]-trimethylsilane is sourced from PubChem (CID 11454222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).