propyl(3-triethoxysilylpropyl)phosphane

C12H29O3PSi — CID 88867738

IUPACpropyl(3-triethoxysilylpropyl)phosphane
SMILESCCCPCCC[Si](OCC)(OCC)OCC
InChIInChI=1S/C12H29O3PSi/c1-5-10-16-11-9-12-17(13-6-2,14-7-3)15-8-4/h16H,5-12H2,1-4H3
InChIKeyYUBKCLGLYPVXNW-UHFFFAOYSA-N
MW280.42 g/mol
LogP3.51
Rot. Bonds12

About propyl(3-triethoxysilylpropyl)phosphane

propyl(3-triethoxysilylpropyl)phosphane (PubChem CID 88867738) has the molecular formula C12H29O3PSi and a molecular weight of 280.42 g/mol. Its IUPAC name is propyl(3-triethoxysilylpropyl)phosphane.

Molecular Properties

Compound Namepropyl(3-triethoxysilylpropyl)phosphane
PubChem CID88867738
Molecular FormulaC12H29O3PSi
Molecular Weight280.42 g/mol
Exact Mass280.16
IUPAC Namepropyl(3-triethoxysilylpropyl)phosphane
SMILESCCCPCCC[Si](OCC)(OCC)OCC
InChIInChI=1S/C12H29O3PSi/c1-5-10-16-11-9-12-17(13-6-2,14-7-3)15-8-4/h16H,5-12H2,1-4H3
InChIKeyYUBKCLGLYPVXNW-UHFFFAOYSA-N
XLogP3.51
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

triethoxy(10-triethoxysilyldecyl)silane
CID 14439044
dodecyl(triethoxy)silane;tridecane
CID 174970002
triethoxy(henicosyl)silane
CID 141362894
triethoxy(pentyl)silane;hydrofluoride
CID 174582602
triethoxy(nonyl)silane;triethoxy(octyl)silane
CID 175508301
triethoxy(nonyl)silane;hydrofluoride
CID 161088856
silane;triethoxy(tetradecyl)silane
CID 161365398
triethoxy(14-iodotetradecyl)silane
CID 87686143
triethoxy(17-iodoheptadecyl)silane
CID 87686040
triethoxy(31-iodohentriacontyl)silane
CID 87683557
triethoxy-[3-(3-triethoxysilylpropoxy)propyl]silane
CID 22616805
heptadecyl(trimethoxy)silane;triethoxy(heptadecyl)silane
CID 161331020

Frequently Asked Questions

What is the IUPAC name of propyl(3-triethoxysilylpropyl)phosphane?
The IUPAC name of propyl(3-triethoxysilylpropyl)phosphane (CID 88867738) is propyl(3-triethoxysilylpropyl)phosphane.
What is the SMILES notation for propyl(3-triethoxysilylpropyl)phosphane?
The canonical SMILES for propyl(3-triethoxysilylpropyl)phosphane is CCCPCCC[Si](OCC)(OCC)OCC.
What is the InChIKey of propyl(3-triethoxysilylpropyl)phosphane?
The InChIKey is YUBKCLGLYPVXNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H29O3PSi/c1-5-10-16-11-9-12-17(13-6-2,14-7-3)15-8-4/h16H,5-12H2,1-4H3.
What are the key properties of propyl(3-triethoxysilylpropyl)phosphane?
propyl(3-triethoxysilylpropyl)phosphane has a molecular weight of 280.42 g/mol, XLogP of 3.51, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propyl(3-triethoxysilylpropyl)phosphane is sourced from PubChem (CID 88867738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).