diethoxy-methyl-(2-phenylethyl)silane

C13H22O2Si — CID 18787774

IUPACdiethoxy-methyl-(2-phenylethyl)silane
SMILESCCO[Si](C)(CCc1ccccc1)OCC
InChIInChI=1S/C13H22O2Si/c1-4-14-16(3,15-5-2)12-11-13-9-7-6-8-10-13/h6-10H,4-5,11-12H2,1-3H3
InChIKeyBHZXSECGGBRQHQ-UHFFFAOYSA-N
MW238.40 g/mol
LogP3.37
Rot. Bonds7

About diethoxy-methyl-(2-phenylethyl)silane

diethoxy-methyl-(2-phenylethyl)silane (PubChem CID 18787774) has the molecular formula C13H22O2Si and a molecular weight of 238.40 g/mol. Its IUPAC name is diethoxy-methyl-(2-phenylethyl)silane.

Molecular Properties

Compound Namediethoxy-methyl-(2-phenylethyl)silane
PubChem CID18787774
Molecular FormulaC13H22O2Si
Molecular Weight238.40 g/mol
Exact Mass238.14
IUPAC Namediethoxy-methyl-(2-phenylethyl)silane
SMILESCCO[Si](C)(CCc1ccccc1)OCC
InChIInChI=1S/C13H22O2Si/c1-4-14-16(3,15-5-2)12-11-13-9-7-6-8-10-13/h6-10H,4-5,11-12H2,1-3H3
InChIKeyBHZXSECGGBRQHQ-UHFFFAOYSA-N
XLogP3.37
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.40
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 diethoxy-methyl-(2-phenylethyl)silane?
The IUPAC name of diethoxy-methyl-(2-phenylethyl)silane (CID 18787774) is diethoxy-methyl-(2-phenylethyl)silane.
What is the SMILES notation for diethoxy-methyl-(2-phenylethyl)silane?
The canonical SMILES for diethoxy-methyl-(2-phenylethyl)silane is CCO[Si](C)(CCc1ccccc1)OCC.
What is the InChIKey of diethoxy-methyl-(2-phenylethyl)silane?
The InChIKey is BHZXSECGGBRQHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22O2Si/c1-4-14-16(3,15-5-2)12-11-13-9-7-6-8-10-13/h6-10H,4-5,11-12H2,1-3H3.
What are the key properties of diethoxy-methyl-(2-phenylethyl)silane?
diethoxy-methyl-(2-phenylethyl)silane has a molecular weight of 238.40 g/mol, XLogP of 3.37, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-methyl-(2-phenylethyl)silane is sourced from PubChem (CID 18787774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).