1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane

C16H30O4Si2 — CID 66858091

IUPAC1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane
SMILESCO[Si](C)(OC)C(C)c1ccccc1C(C)[Si](C)(OC)OC
InChIInChI=1S/C16H30O4Si2/c1-13(21(7,17-3)18-4)15-11-9-10-12-16(15)14(2)22(8,19-5)20-6/h9-14H,1-8H3
InChIKeyKBUZAJFRGSLACK-UHFFFAOYSA-N
MW342.58 g/mol
LogP3.70
Rot. Bonds8

About 1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane

1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane (PubChem CID 66858091) has the molecular formula C16H30O4Si2 and a molecular weight of 342.58 g/mol. Its IUPAC name is 1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane.

Molecular Properties

Compound Name1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane
PubChem CID66858091
Molecular FormulaC16H30O4Si2
Molecular Weight342.58 g/mol
Exact Mass342.17
IUPAC Name1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane
SMILESCO[Si](C)(OC)C(C)c1ccccc1C(C)[Si](C)(OC)OC
InChIInChI=1S/C16H30O4Si2/c1-13(21(7,17-3)18-4)15-11-9-10-12-16(15)14(2)22(8,19-5)20-6/h9-14H,1-8H3
InChIKeyKBUZAJFRGSLACK-UHFFFAOYSA-N
XLogP3.70
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.58
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane?
The IUPAC name of 1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane (CID 66858091) is 1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane.
What is the SMILES notation for 1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane?
The canonical SMILES for 1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane is CO[Si](C)(OC)C(C)c1ccccc1C(C)[Si](C)(OC)OC.
What is the InChIKey of 1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane?
The InChIKey is KBUZAJFRGSLACK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30O4Si2/c1-13(21(7,17-3)18-4)15-11-9-10-12-16(15)14(2)22(8,19-5)20-6/h9-14H,1-8H3.
What are the key properties of 1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane?
1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane has a molecular weight of 342.58 g/mol, XLogP of 3.70, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[1-[dimethoxy(methyl)silyl]ethyl]phenyl]ethyl-dimethoxy-methylsilane is sourced from PubChem (CID 66858091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).