4-[methyl(diphenyl)silyl]butan-1-ol

C17H22OSi — CID 4583561

IUPAC4-[methyl(diphenyl)silyl]butan-1-ol
SMILESC[Si](CCCCO)(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H22OSi/c1-19(15-9-8-14-18,16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-7,10-13,18H,8-9,14-15H2,1H3
InChIKeyXICASLQNVVCMNQ-UHFFFAOYSA-N
MW270.45 g/mol
LogP2.65
Rot. Bonds6

About 4-[methyl(diphenyl)silyl]butan-1-ol

4-[methyl(diphenyl)silyl]butan-1-ol (PubChem CID 4583561) has the molecular formula C17H22OSi and a molecular weight of 270.45 g/mol. Its IUPAC name is 4-[methyl(diphenyl)silyl]butan-1-ol.

Molecular Properties

Compound Name4-[methyl(diphenyl)silyl]butan-1-ol
PubChem CID4583561
Molecular FormulaC17H22OSi
Molecular Weight270.45 g/mol
Exact Mass270.14
IUPAC Name4-[methyl(diphenyl)silyl]butan-1-ol
SMILESC[Si](CCCCO)(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H22OSi/c1-19(15-9-8-14-18,16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-7,10-13,18H,8-9,14-15H2,1H3
InChIKeyXICASLQNVVCMNQ-UHFFFAOYSA-N
XLogP2.65
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.45
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[methyl(diphenyl)silyl]butan-1-ol?
The IUPAC name of 4-[methyl(diphenyl)silyl]butan-1-ol (CID 4583561) is 4-[methyl(diphenyl)silyl]butan-1-ol.
What is the SMILES notation for 4-[methyl(diphenyl)silyl]butan-1-ol?
The canonical SMILES for 4-[methyl(diphenyl)silyl]butan-1-ol is C[Si](CCCCO)(c1ccccc1)c1ccccc1.
What is the InChIKey of 4-[methyl(diphenyl)silyl]butan-1-ol?
The InChIKey is XICASLQNVVCMNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22OSi/c1-19(15-9-8-14-18,16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-7,10-13,18H,8-9,14-15H2,1H3.
What are the key properties of 4-[methyl(diphenyl)silyl]butan-1-ol?
4-[methyl(diphenyl)silyl]butan-1-ol has a molecular weight of 270.45 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[methyl(diphenyl)silyl]butan-1-ol is sourced from PubChem (CID 4583561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).