trimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane

C19H42OSi2Sn — CID 10939496

IUPACtrimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane
SMILESCC(C)[Sn](C(C)C)(C(C)C)C(C)(C#C[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C10H21OSi2.3C3H7.Sn/c1-10(11-13(5,6)7)8-9-12(2,3)4;3*1-3-2;/h1-7H3;3*3H,1-2H3;
InChIKeyJLNXKNWBZQIHEZ-UHFFFAOYSA-N
MW461.43 g/mol
LogP6.70
Rot. Bonds6

About trimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane

trimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane (PubChem CID 10939496) has the molecular formula C19H42OSi2Sn and a molecular weight of 461.43 g/mol. Its IUPAC name is trimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane.

Molecular Properties

Compound Nametrimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane
PubChem CID10939496
Molecular FormulaC19H42OSi2Sn
Molecular Weight461.43 g/mol
Exact Mass462.18
IUPAC Nametrimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane
SMILESCC(C)[Sn](C(C)C)(C(C)C)C(C)(C#C[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C10H21OSi2.3C3H7.Sn/c1-10(11-13(5,6)7)8-9-12(2,3)4;3*1-3-2;/h1-7H3;3*3H,1-2H3;
InChIKeyJLNXKNWBZQIHEZ-UHFFFAOYSA-N
XLogP6.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500461.43
LogP ≤ 56.70
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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Frequently Asked Questions

What is the IUPAC name of trimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane?
The IUPAC name of trimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane (CID 10939496) is trimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane.
What is the SMILES notation for trimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane?
The canonical SMILES for trimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane is CC(C)[Sn](C(C)C)(C(C)C)C(C)(C#C[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane?
The InChIKey is JLNXKNWBZQIHEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21OSi2.3C3H7.Sn/c1-10(11-13(5,6)7)8-9-12(2,3)4;3*1-3-2;/h1-7H3;3*3H,1-2H3;.
What are the key properties of trimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane?
trimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane has a molecular weight of 461.43 g/mol, XLogP of 6.70, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[3-trimethylsilyloxy-3-tri(propan-2-yl)stannylbut-1-ynyl]silane is sourced from PubChem (CID 10939496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).