trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane

C16H30O6Si2 — CID 56847492

IUPACtrimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane
SMILESCO[Si](CCc1cccc(CC[Si](OC)(OC)OC)c1)(OC)OC
InChIInChI=1S/C16H30O6Si2/c1-17-23(18-2,19-3)12-10-15-8-7-9-16(14-15)11-13-24(20-4,21-5)22-6/h7-9,14H,10-13H2,1-6H3
InChIKeyNUUYHDXULKOYIW-UHFFFAOYSA-N
MW374.58 g/mol
LogP2.53
Rot. Bonds12

About trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane

trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane (PubChem CID 56847492) has the molecular formula C16H30O6Si2 and a molecular weight of 374.58 g/mol. Its IUPAC name is trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane.

Molecular Properties

Compound Nametrimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane
PubChem CID56847492
Molecular FormulaC16H30O6Si2
Molecular Weight374.58 g/mol
Exact Mass374.16
IUPAC Nametrimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane
SMILESCO[Si](CCc1cccc(CC[Si](OC)(OC)OC)c1)(OC)OC
InChIInChI=1S/C16H30O6Si2/c1-17-23(18-2,19-3)12-10-15-8-7-9-16(14-15)11-13-24(20-4,21-5)22-6/h7-9,14H,10-13H2,1-6H3
InChIKeyNUUYHDXULKOYIW-UHFFFAOYSA-N
XLogP2.53
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.58
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-(3,4-dimethylphenyl)ethyl-trimethoxysilane
CID 59566689
trimethoxy(2-phenylethyl)silane;trimethoxy(propyl)silane
CID 70127509
ethoxy-dimethoxy-[2-[3-(trifluoromethyl)phenyl]ethyl]silane
CID 90171970
2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane
CID 59566880
[bis(hydroxymethyl)-[2-[4-(2-trimethoxysilylethyl)phenyl]ethyl]silyl]methanol
CID 123655126
2-[dimethoxy(2-phenylethyl)silyl]oxyethanethiol
CID 87336831
2-(4-tert-butylphenyl)ethyl-trimethoxysilane
CID 139668437
triethynoxy-[2-(3-methylphenyl)ethyl]silane
CID 59566847
2-(2,2-dimethyl-1,3-benzodioxol-5-yl)ethyl-trimethoxysilane
CID 170900368
trimethoxy(12-phenyldodecyl)silane
CID 54325157
dimethoxy-methyl-[2-[3-(trifluoromethyl)phenyl]ethyl]silane
CID 90174085
1-[3-[2-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane
CID 67331069

Frequently Asked Questions

What is the IUPAC name of trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane?
The IUPAC name of trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane (CID 56847492) is trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane.
What is the SMILES notation for trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane?
The canonical SMILES for trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane is CO[Si](CCc1cccc(CC[Si](OC)(OC)OC)c1)(OC)OC.
What is the InChIKey of trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane?
The InChIKey is NUUYHDXULKOYIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30O6Si2/c1-17-23(18-2,19-3)12-10-15-8-7-9-16(14-15)11-13-24(20-4,21-5)22-6/h7-9,14H,10-13H2,1-6H3.
What are the key properties of trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane?
trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane has a molecular weight of 374.58 g/mol, XLogP of 2.53, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane is sourced from PubChem (CID 56847492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).