trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane

C15H26O6Si — CID 174513383

IUPACtrimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane
SMILESCOc1ccc(CCC[Si](OC)(OC)OC)c(OC)c1OC
InChIInChI=1S/C15H26O6Si/c1-16-13-10-9-12(14(17-2)15(13)18-3)8-7-11-22(19-4,20-5)21-6/h9-10H,7-8,11H2,1-6H3
InChIKeyCWKCNLIFWYPUQN-UHFFFAOYSA-N
MW330.45 g/mol
LogP2.52
Rot. Bonds10

About trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane

trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane (PubChem CID 174513383) has the molecular formula C15H26O6Si and a molecular weight of 330.45 g/mol. Its IUPAC name is trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane.

Molecular Properties

Compound Nametrimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane
PubChem CID174513383
Molecular FormulaC15H26O6Si
Molecular Weight330.45 g/mol
Exact Mass330.15
IUPAC Nametrimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane
SMILESCOc1ccc(CCC[Si](OC)(OC)OC)c(OC)c1OC
InChIInChI=1S/C15H26O6Si/c1-16-13-10-9-12(14(17-2)15(13)18-3)8-7-11-22(19-4,20-5)21-6/h9-10H,7-8,11H2,1-6H3
InChIKeyCWKCNLIFWYPUQN-UHFFFAOYSA-N
XLogP2.52
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.45
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]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

3-(2,3,4-trimethoxyphenyl)propan-1-ol
CID 11790895
2-[2-(2,3,4-trimethoxyphenyl)ethoxy]ethanamine
CID 65305545
3,3-dimethyl-5-(2,3,4-trimethoxyphenyl)pentan-1-amine
CID 65305448
ethyl 5-(2,3,4-trimethoxyphenyl)pentanoate
CID 144536169
1-[3-(2,3,4-trimethoxyphenyl)propyl]piperazine
CID 83934072
4-[2-(2,3,4-trimethoxyphenyl)ethyl]-2H-triazole
CID 112718797
2-methyl-N-[2-(2,3,4-trimethoxyphenyl)ethyl]propan-2-amine
CID 64865802
1-hept-3-ynyl-2,3,4-trimethoxybenzene
CID 83934109
1-hex-3-ynyl-2,3,4-trimethoxybenzene
CID 83934105
3-(2,3,4-trimethoxyphenyl)propyl 2-methylprop-2-enoate
CID 175430162
4-[(3,4-dimethoxy-2-nitrophenyl)methoxy]butyl-trimethoxysilane
CID 89253844
1,3-dibutyl-2,4-dimethoxybenzene
CID 162495747

Frequently Asked Questions

What is the IUPAC name of trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane?
The IUPAC name of trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane (CID 174513383) is trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane.
What is the SMILES notation for trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane?
The canonical SMILES for trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane is COc1ccc(CCC[Si](OC)(OC)OC)c(OC)c1OC.
What is the InChIKey of trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane?
The InChIKey is CWKCNLIFWYPUQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O6Si/c1-16-13-10-9-12(14(17-2)15(13)18-3)8-7-11-22(19-4,20-5)21-6/h9-10H,7-8,11H2,1-6H3.
What are the key properties of trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane?
trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane has a molecular weight of 330.45 g/mol, XLogP of 2.52, 10 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy-[3-(2,3,4-trimethoxyphenyl)propyl]silane is sourced from PubChem (CID 174513383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).