(3-methyl-3-triethoxysilylbutyl)phosphane

C11H27O3PSi — CID 174985696

IUPAC(3-methyl-3-triethoxysilylbutyl)phosphane
SMILESCCO[Si](OCC)(OCC)C(C)(C)CCP
InChIInChI=1S/C11H27O3PSi/c1-6-12-16(13-7-2,14-8-3)11(4,5)9-10-15/h6-10,15H2,1-5H3
InChIKeyDXPNYMGKGLTTNK-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.08
Rot. Bonds9

About (3-methyl-3-triethoxysilylbutyl)phosphane

(3-methyl-3-triethoxysilylbutyl)phosphane (PubChem CID 174985696) has the molecular formula C11H27O3PSi and a molecular weight of 266.39 g/mol. Its IUPAC name is (3-methyl-3-triethoxysilylbutyl)phosphane.

Molecular Properties

Compound Name(3-methyl-3-triethoxysilylbutyl)phosphane
PubChem CID174985696
Molecular FormulaC11H27O3PSi
Molecular Weight266.39 g/mol
Exact Mass266.15
IUPAC Name(3-methyl-3-triethoxysilylbutyl)phosphane
SMILESCCO[Si](OCC)(OCC)C(C)(C)CCP
InChIInChI=1S/C11H27O3PSi/c1-6-12-16(13-7-2,14-8-3)11(4,5)9-10-15/h6-10,15H2,1-5H3
InChIKeyDXPNYMGKGLTTNK-UHFFFAOYSA-N
XLogP3.08
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3-methyl-3-triethoxysilylbutyl)phosphane?
The IUPAC name of (3-methyl-3-triethoxysilylbutyl)phosphane (CID 174985696) is (3-methyl-3-triethoxysilylbutyl)phosphane.
What is the SMILES notation for (3-methyl-3-triethoxysilylbutyl)phosphane?
The canonical SMILES for (3-methyl-3-triethoxysilylbutyl)phosphane is CCO[Si](OCC)(OCC)C(C)(C)CCP.
What is the InChIKey of (3-methyl-3-triethoxysilylbutyl)phosphane?
The InChIKey is DXPNYMGKGLTTNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27O3PSi/c1-6-12-16(13-7-2,14-8-3)11(4,5)9-10-15/h6-10,15H2,1-5H3.
What are the key properties of (3-methyl-3-triethoxysilylbutyl)phosphane?
(3-methyl-3-triethoxysilylbutyl)phosphane has a molecular weight of 266.39 g/mol, XLogP of 3.08, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-3-triethoxysilylbutyl)phosphane is sourced from PubChem (CID 174985696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).