1-dipropylphosphorylethyl(triethoxy)silane

C14H33O4PSi — CID 175367708

IUPAC1-dipropylphosphorylethyl(triethoxy)silane
SMILESCCCP(=O)(CCC)C(C)[Si](OCC)(OCC)OCC
InChIInChI=1S/C14H33O4PSi/c1-7-12-19(15,13-8-2)14(6)20(16-9-3,17-10-4)18-11-5/h14H,7-13H2,1-6H3
InChIKeyLYGXVXPUMIYXIK-UHFFFAOYSA-N
MW324.47 g/mol
LogP4.15
Rot. Bonds12

About 1-dipropylphosphorylethyl(triethoxy)silane

1-dipropylphosphorylethyl(triethoxy)silane (PubChem CID 175367708) has the molecular formula C14H33O4PSi and a molecular weight of 324.47 g/mol. Its IUPAC name is 1-dipropylphosphorylethyl(triethoxy)silane.

Molecular Properties

Compound Name1-dipropylphosphorylethyl(triethoxy)silane
PubChem CID175367708
Molecular FormulaC14H33O4PSi
Molecular Weight324.47 g/mol
Exact Mass324.19
IUPAC Name1-dipropylphosphorylethyl(triethoxy)silane
SMILESCCCP(=O)(CCC)C(C)[Si](OCC)(OCC)OCC
InChIInChI=1S/C14H33O4PSi/c1-7-12-19(15,13-8-2)14(6)20(16-9-3,17-10-4)18-11-5/h14H,7-13H2,1-6H3
InChIKeyLYGXVXPUMIYXIK-UHFFFAOYSA-N
XLogP4.15
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.47
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-dipropylphosphorylethyl(triethoxy)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-diethylphosphorylethyl(triethoxy)silane
CID 87390824
1-dimethylphosphorylethyl(triethoxy)silane
CID 175367716
1-dipropylphosphoryl-1-ethoxy-N,N-dimethylmethanamine
CID 14954183
4-methyl-1-triethoxysilylhexan-1-amine
CID 175249037
2-dimethylphosphorylethyl(triethoxy)silane
CID 141433180
2-triethoxysilylpropanoate
CID 22068871
3,3-dimethylbutan-2-yl(triethoxy)silane
CID 91365282
lithium;[bis(triethoxysilyl)methylsulfanyl-triethoxysilylmethyl]-triethoxysilane;hydride
CID 173214345
triethoxy-[1,3,3-tris(triethoxysilyl)propyl]silane
CID 22222937
O-methyl 2-triethoxysilylpropanethioate
CID 141147284
(3,3-difluoro-4-triethoxysilylpentan-2-yl)-triethoxysilane
CID 87839555
1-triethoxysilyldecan-1-amine
CID 87463354

Frequently Asked Questions

What is the IUPAC name of 1-dipropylphosphorylethyl(triethoxy)silane?
The IUPAC name of 1-dipropylphosphorylethyl(triethoxy)silane (CID 175367708) is 1-dipropylphosphorylethyl(triethoxy)silane.
What is the SMILES notation for 1-dipropylphosphorylethyl(triethoxy)silane?
The canonical SMILES for 1-dipropylphosphorylethyl(triethoxy)silane is CCCP(=O)(CCC)C(C)[Si](OCC)(OCC)OCC.
What is the InChIKey of 1-dipropylphosphorylethyl(triethoxy)silane?
The InChIKey is LYGXVXPUMIYXIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H33O4PSi/c1-7-12-19(15,13-8-2)14(6)20(16-9-3,17-10-4)18-11-5/h14H,7-13H2,1-6H3.
What are the key properties of 1-dipropylphosphorylethyl(triethoxy)silane?
1-dipropylphosphorylethyl(triethoxy)silane has a molecular weight of 324.47 g/mol, XLogP of 4.15, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-dipropylphosphorylethyl(triethoxy)silane is sourced from PubChem (CID 175367708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).