tris(2-methoxyethyl(dimethyl)silane);phosphoric acid

C15H45O7PSi3 — CID 175944231

IUPACtris(2-methoxyethyl(dimethyl)silane);phosphoric acid
SMILESCOCC[SiH](C)C.COCC[SiH](C)C.COCC[SiH](C)C.O=P(O)(O)O
InChIInChI=1S/3C5H14OSi.H3O4P/c3*1-6-4-5-7(2)3;1-5(2,3)4/h3*7H,4-5H2,1-3H3;(H3,1,2,3,4)
InChIKeyXQNWDXNJNGTFDG-UHFFFAOYSA-N
MW452.75 g/mol
LogP2.43
Rot. Bonds9

About tris(2-methoxyethyl(dimethyl)silane);phosphoric acid

tris(2-methoxyethyl(dimethyl)silane);phosphoric acid (PubChem CID 175944231) has the molecular formula C15H45O7PSi3 and a molecular weight of 452.75 g/mol. Its IUPAC name is tris(2-methoxyethyl(dimethyl)silane);phosphoric acid.

Molecular Properties

Compound Nametris(2-methoxyethyl(dimethyl)silane);phosphoric acid
PubChem CID175944231
Molecular FormulaC15H45O7PSi3
Molecular Weight452.75 g/mol
Exact Mass452.22
IUPAC Nametris(2-methoxyethyl(dimethyl)silane);phosphoric acid
SMILESCOCC[SiH](C)C.COCC[SiH](C)C.COCC[SiH](C)C.O=P(O)(O)O
InChIInChI=1S/3C5H14OSi.H3O4P/c3*1-6-4-5-7(2)3;1-5(2,3)4/h3*7H,4-5H2,1-3H3;(H3,1,2,3,4)
InChIKeyXQNWDXNJNGTFDG-UHFFFAOYSA-N
XLogP2.43
TPSA105.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500452.75
LogP ≤ 52.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze tris(2-methoxyethyl(dimethyl)silane);phosphoric acid 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

hydroxy(dimethyl)silane;phosphoric acid
CID 175364344
methyl hypochlorite;phosphoric acid
CID 175163315
dimethyl(silyloxy)silane;phosphoric acid
CID 173241778
2-aminoethyl 2-methoxyethyl hydrogen phosphate
CID 59087649
ethyl-bis(2-methoxyethyl)silane
CID 158444639
methoxy(methoxymethyl)phosphinic acid
CID 54547216
ethane-1,2-diamine;methylphosphonic acid
CID 19349473
aluminum;hydron;phosphoric acid
CID 173045384
2-methoxyethanesulfonyl chloride
CID 13480221
phosphoric acid;tris(triethylsilane)
CID 158157117
disodium;1,2-dimethoxyethane;carbonate
CID 86669059
ethenyl-bis(2-methoxyethyl)silane
CID 158755504

Frequently Asked Questions

What is the IUPAC name of tris(2-methoxyethyl(dimethyl)silane);phosphoric acid?
The IUPAC name of tris(2-methoxyethyl(dimethyl)silane);phosphoric acid (CID 175944231) is tris(2-methoxyethyl(dimethyl)silane);phosphoric acid.
What is the SMILES notation for tris(2-methoxyethyl(dimethyl)silane);phosphoric acid?
The canonical SMILES for tris(2-methoxyethyl(dimethyl)silane);phosphoric acid is COCC[SiH](C)C.COCC[SiH](C)C.COCC[SiH](C)C.O=P(O)(O)O.
What is the InChIKey of tris(2-methoxyethyl(dimethyl)silane);phosphoric acid?
The InChIKey is XQNWDXNJNGTFDG-UHFFFAOYSA-N. The full InChI is InChI=1S/3C5H14OSi.H3O4P/c3*1-6-4-5-7(2)3;1-5(2,3)4/h3*7H,4-5H2,1-3H3;(H3,1,2,3,4).
What are the key properties of tris(2-methoxyethyl(dimethyl)silane);phosphoric acid?
tris(2-methoxyethyl(dimethyl)silane);phosphoric acid has a molecular weight of 452.75 g/mol, XLogP of 2.43, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tris(2-methoxyethyl(dimethyl)silane);phosphoric acid is sourced from PubChem (CID 175944231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).