CID 58952884

C14H33O9Si4 — CID 58952884

IUPAC—
SMILESCO[Si](CC[Si]1(C)OCO[Si](C)(CCOCC2CO2)O[Si](C)O1)(OC)OC
InChIInChI=1S/C14H33O9Si4/c1-15-27(16-2,17-3)10-9-26(6)21-13-20-25(5,22-24(4)23-26)8-7-18-11-14-12-19-14/h14H,7-13H2,1-6H3
InChIKeyWXPGSXBMAVCKEG-UHFFFAOYSA-N
MW457.75 g/mol
LogP1.58
Rot. Bonds11

About CID 58952884

CID 58952884 (PubChem CID 58952884) has the molecular formula C14H33O9Si4 and a molecular weight of 457.75 g/mol.

Molecular Properties

Compound NameCID 58952884
PubChem CID58952884
Molecular FormulaC14H33O9Si4
Molecular Weight457.75 g/mol
Exact Mass457.12
IUPAC Name—
SMILESCO[Si](CC[Si]1(C)OCO[Si](C)(CCOCC2CO2)O[Si](C)O1)(OC)OC
InChIInChI=1S/C14H33O9Si4/c1-15-27(16-2,17-3)10-9-26(6)21-13-20-25(5,22-24(4)23-26)8-7-18-11-14-12-19-14/h14H,7-13H2,1-6H3
InChIKeyWXPGSXBMAVCKEG-UHFFFAOYSA-N
XLogP1.58
TPSA86.37 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds11
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500457.75
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze CID 58952884 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

trimethoxy-[2-(oxiran-2-ylmethoxy)ethyl]silane
CID 10130712
oxiran-2-ylmethoxysilane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 159211950
butan-2-one;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 174775957
trimethoxy-[2-[2,4,6-trimethyl-2-[3-(oxiran-2-ylmethoxy)propyl]-1,3,5,2,4,6-trioxatrisilecan-6-yl]ethyl]silane
CID 162697457
ethoxysilane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 161088311
2-[2-hydroxyethoxy-methoxy-[3-(oxiran-2-ylmethoxy)propyl]silyl]oxyethanol
CID 87722976
2,4,6,8-tetramethyl-2,4,6-tris[3-(oxiran-2-ylmethoxy)propyl]-8-propyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 140764013
CID 20751921
CID 20751921
dimethoxy-(2-methylpropoxy)-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 169273482
2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane
CID 90384181
3-(oxiran-2-ylmethoxy)propyl tris(prop-1-en-2-yl) silicate;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 88618101
dimethyl-[2-(oxiran-2-ylmethoxy)ethyl]-(2-trimethylsilylethyl)silane
CID 58242723

Frequently Asked Questions

What is the IUPAC name of CID 58952884?
The IUPAC name of CID 58952884 (CID 58952884) is not available.
What is the SMILES notation for CID 58952884?
The canonical SMILES for CID 58952884 is CO[Si](CC[Si]1(C)OCO[Si](C)(CCOCC2CO2)O[Si](C)O1)(OC)OC.
What is the InChIKey of CID 58952884?
The InChIKey is WXPGSXBMAVCKEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H33O9Si4/c1-15-27(16-2,17-3)10-9-26(6)21-13-20-25(5,22-24(4)23-26)8-7-18-11-14-12-19-14/h14H,7-13H2,1-6H3.
What are the key properties of CID 58952884?
CID 58952884 has a molecular weight of 457.75 g/mol, XLogP of 1.58, 11 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58952884 is sourced from PubChem (CID 58952884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).