(3,5-dimethoxy-2-methylphenyl)-trimethoxysilane

C12H20O5Si — CID 59566684

IUPAC(3,5-dimethoxy-2-methylphenyl)-trimethoxysilane
SMILESCOc1cc(OC)c(C)c([Si](OC)(OC)OC)c1
InChIInChI=1S/C12H20O5Si/c1-9-11(14-3)7-10(13-2)8-12(9)18(15-4,16-5)17-6/h7-8H,1-6H3
InChIKeyMBPKLNKTVSMXBF-UHFFFAOYSA-N
MW272.37 g/mol
LogP1.10
Rot. Bonds6

About (3,5-dimethoxy-2-methylphenyl)-trimethoxysilane

(3,5-dimethoxy-2-methylphenyl)-trimethoxysilane (PubChem CID 59566684) has the molecular formula C12H20O5Si and a molecular weight of 272.37 g/mol. Its IUPAC name is (3,5-dimethoxy-2-methylphenyl)-trimethoxysilane.

Molecular Properties

Compound Name(3,5-dimethoxy-2-methylphenyl)-trimethoxysilane
PubChem CID59566684
Molecular FormulaC12H20O5Si
Molecular Weight272.37 g/mol
Exact Mass272.11
IUPAC Name(3,5-dimethoxy-2-methylphenyl)-trimethoxysilane
SMILESCOc1cc(OC)c(C)c([Si](OC)(OC)OC)c1
InChIInChI=1S/C12H20O5Si/c1-9-11(14-3)7-10(13-2)8-12(9)18(15-4,16-5)17-6/h7-8H,1-6H3
InChIKeyMBPKLNKTVSMXBF-UHFFFAOYSA-N
XLogP1.10
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 51.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3,5-dimethoxy-2-methylphenyl)-trimethoxysilane?
The IUPAC name of (3,5-dimethoxy-2-methylphenyl)-trimethoxysilane (CID 59566684) is (3,5-dimethoxy-2-methylphenyl)-trimethoxysilane.
What is the SMILES notation for (3,5-dimethoxy-2-methylphenyl)-trimethoxysilane?
The canonical SMILES for (3,5-dimethoxy-2-methylphenyl)-trimethoxysilane is COc1cc(OC)c(C)c([Si](OC)(OC)OC)c1.
What is the InChIKey of (3,5-dimethoxy-2-methylphenyl)-trimethoxysilane?
The InChIKey is MBPKLNKTVSMXBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O5Si/c1-9-11(14-3)7-10(13-2)8-12(9)18(15-4,16-5)17-6/h7-8H,1-6H3.
What are the key properties of (3,5-dimethoxy-2-methylphenyl)-trimethoxysilane?
(3,5-dimethoxy-2-methylphenyl)-trimethoxysilane has a molecular weight of 272.37 g/mol, XLogP of 1.10, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethoxy-2-methylphenyl)-trimethoxysilane is sourced from PubChem (CID 59566684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).