triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane

C16H28O4Si — CID 59566888

IUPACtriethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane
SMILESCCO[Si](Cc1c(OC)ccc(C)c1C)(OCC)OCC
InChIInChI=1S/C16H28O4Si/c1-7-18-21(19-8-2,20-9-3)12-15-14(5)13(4)10-11-16(15)17-6/h10-11H,7-9,12H2,1-6H3
InChIKeyMTPBFOPTIWKZRN-UHFFFAOYSA-N
MW312.48 g/mol
LogP3.44
Rot. Bonds9

About triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane

triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane (PubChem CID 59566888) has the molecular formula C16H28O4Si and a molecular weight of 312.48 g/mol. Its IUPAC name is triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane.

Molecular Properties

Compound Nametriethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane
PubChem CID59566888
Molecular FormulaC16H28O4Si
Molecular Weight312.48 g/mol
Exact Mass312.18
IUPAC Nametriethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane
SMILESCCO[Si](Cc1c(OC)ccc(C)c1C)(OCC)OCC
InChIInChI=1S/C16H28O4Si/c1-7-18-21(19-8-2,20-9-3)12-15-14(5)13(4)10-11-16(15)17-6/h10-11H,7-9,12H2,1-6H3
InChIKeyMTPBFOPTIWKZRN-UHFFFAOYSA-N
XLogP3.44
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.48
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

triethoxy-[(2-methoxy-6-methylphenyl)methyl]silane
CID 59566744
triethoxy-(6-methoxy-2,3-dimethylphenyl)silane
CID 59566878
2-butyl-1-methoxy-3,4-dimethylbenzene
CID 150631165
triethoxy-[(3-methoxy-2,5-dimethylphenyl)methyl]silane
CID 59566922
triethoxy-[(5-methoxy-2,4-dimethylphenyl)methyl]silane
CID 59566722
triethoxy-[2-(2,3,6-trimethoxyphenyl)ethyl]silane
CID 90121012
triethoxy-[2-(2-methoxy-3,6-dimethylphenyl)ethyl]silane
CID 90121058
triethoxy-[(5-methoxy-2-methylphenyl)methyl]silane
CID 59566772
1-(6-methoxy-2,3-dimethylphenyl)propan-2-amine
CID 117284120
triethoxy-[2-(3-methoxy-2,5-dimethylphenyl)ethyl]silane
CID 90121057
triethoxy-[3-methoxy-2-(2-triethoxysilylethyl)phenyl]silane
CID 59566709
2-(2,3-dimethoxyphenyl)ethyl-triethoxysilane
CID 90120995

Frequently Asked Questions

What is the IUPAC name of triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane?
The IUPAC name of triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane (CID 59566888) is triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane.
What is the SMILES notation for triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane?
The canonical SMILES for triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane is CCO[Si](Cc1c(OC)ccc(C)c1C)(OCC)OCC.
What is the InChIKey of triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane?
The InChIKey is MTPBFOPTIWKZRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28O4Si/c1-7-18-21(19-8-2,20-9-3)12-15-14(5)13(4)10-11-16(15)17-6/h10-11H,7-9,12H2,1-6H3.
What are the key properties of triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane?
triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane has a molecular weight of 312.48 g/mol, XLogP of 3.44, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[(6-methoxy-2,3-dimethylphenyl)methyl]silane is sourced from PubChem (CID 59566888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).