2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane

C13H22O5Si — CID 59566880

IUPAC2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane
SMILESCOc1cc(CC[Si](OC)(OC)OC)cc(OC)c1
InChIInChI=1S/C13H22O5Si/c1-14-12-8-11(9-13(10-12)15-2)6-7-19(16-3,17-4)18-5/h8-10H,6-7H2,1-5H3
InChIKeyDGCGOSFETYCNRA-UHFFFAOYSA-N
MW286.40 g/mol
LogP2.12
Rot. Bonds8

About 2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane

2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane (PubChem CID 59566880) has the molecular formula C13H22O5Si and a molecular weight of 286.40 g/mol. Its IUPAC name is 2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane.

Molecular Properties

Compound Name2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane
PubChem CID59566880
Molecular FormulaC13H22O5Si
Molecular Weight286.40 g/mol
Exact Mass286.12
IUPAC Name2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane
SMILESCOc1cc(CC[Si](OC)(OC)OC)cc(OC)c1
InChIInChI=1S/C13H22O5Si/c1-14-12-8-11(9-13(10-12)15-2)6-7-19(16-3,17-4)18-5/h8-10H,6-7H2,1-5H3
InChIKeyDGCGOSFETYCNRA-UHFFFAOYSA-N
XLogP2.12
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-[2-(3,5-dimethoxyphenyl)ethyl]-3,5-dimethoxybenzene
CID 4670736
1-(2-bromoethyl)-3,5-dimethoxybenzene
CID 12560827
1-butyl-3,5-dimethoxybenzene
CID 524875
sodium 2-(3,5-dimethoxyphenyl)ethanolate
CID 175142417
trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane
CID 56847492
trimethoxy-[2-(5-methoxy-2,3-dimethylphenyl)ethyl]silane
CID 90121000
1,3-dimethoxy-5-(2-nitrosoethyl)benzene
CID 132967337
2-[2-(3,5-dimethoxyphenyl)ethyl]-1,3-dioxolane
CID 12068613
[bis(hydroxymethyl)-[2-[4-(2-trimethoxysilylethyl)phenyl]ethyl]silyl]methanol
CID 123655126
phosphane;1,3,5-trimethoxybenzene
CID 175232895
N-[2-(3,5-dimethoxyphenyl)ethyl]propan-1-amine
CID 64865776
1-methoxy-3-[2-(4-methoxyphenyl)ethyl]-5-[4-[2-(4-methoxyphenyl)ethyl]phenoxy]benzene
CID 172871171

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane?
The IUPAC name of 2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane (CID 59566880) is 2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane.
What is the SMILES notation for 2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane?
The canonical SMILES for 2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane is COc1cc(CC[Si](OC)(OC)OC)cc(OC)c1.
What is the InChIKey of 2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane?
The InChIKey is DGCGOSFETYCNRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22O5Si/c1-14-12-8-11(9-13(10-12)15-2)6-7-19(16-3,17-4)18-5/h8-10H,6-7H2,1-5H3.
What are the key properties of 2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane?
2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane has a molecular weight of 286.40 g/mol, XLogP of 2.12, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane is sourced from PubChem (CID 59566880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).