diethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane

C10H27O4PSi — CID 88596875

IUPACdiethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane
SMILESCCOC(OCC)P(O)(O)(CC)[Si](C)(C)C
InChIInChI=1S/C10H27O4PSi/c1-7-13-10(14-8-2)15(11,12,9-3)16(4,5)6/h10-12H,7-9H2,1-6H3
InChIKeyAJTQQERWSUNDKG-UHFFFAOYSA-N
MW270.38 g/mol
LogP2.57
Rot. Bonds7

About diethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane

diethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane (PubChem CID 88596875) has the molecular formula C10H27O4PSi and a molecular weight of 270.38 g/mol. Its IUPAC name is diethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane.

Molecular Properties

Compound Namediethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane
PubChem CID88596875
Molecular FormulaC10H27O4PSi
Molecular Weight270.38 g/mol
Exact Mass270.14
IUPAC Namediethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane
SMILESCCOC(OCC)P(O)(O)(CC)[Si](C)(C)C
InChIInChI=1S/C10H27O4PSi/c1-7-13-10(14-8-2)15(11,12,9-3)16(4,5)6/h10-12H,7-9H2,1-6H3
InChIKeyAJTQQERWSUNDKG-UHFFFAOYSA-N
XLogP2.57
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of diethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane?
The IUPAC name of diethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane (CID 88596875) is diethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane.
What is the SMILES notation for diethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane?
The canonical SMILES for diethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane is CCOC(OCC)P(O)(O)(CC)[Si](C)(C)C.
What is the InChIKey of diethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane?
The InChIKey is AJTQQERWSUNDKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H27O4PSi/c1-7-13-10(14-8-2)15(11,12,9-3)16(4,5)6/h10-12H,7-9H2,1-6H3.
What are the key properties of diethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane?
diethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane has a molecular weight of 270.38 g/mol, XLogP of 2.57, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxymethyl-ethyl-dihydroxy-trimethylsilyl-λ5-phosphane is sourced from PubChem (CID 88596875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).