dibutoxy-methyl-(1-methylcyclohexyl)silane

C16H34O2Si — CID 19820270

IUPACdibutoxy-methyl-(1-methylcyclohexyl)silane
SMILESCCCCO[Si](C)(OCCCC)C1(C)CCCCC1
InChIInChI=1S/C16H34O2Si/c1-5-7-14-17-19(4,18-15-8-6-2)16(3)12-10-9-11-13-16/h5-15H2,1-4H3
InChIKeyUAYJUXRDPDDJQW-UHFFFAOYSA-N
MW286.53 g/mol
LogP5.42
Rot. Bonds9

About dibutoxy-methyl-(1-methylcyclohexyl)silane

dibutoxy-methyl-(1-methylcyclohexyl)silane (PubChem CID 19820270) has the molecular formula C16H34O2Si and a molecular weight of 286.53 g/mol. Its IUPAC name is dibutoxy-methyl-(1-methylcyclohexyl)silane.

Molecular Properties

Compound Namedibutoxy-methyl-(1-methylcyclohexyl)silane
PubChem CID19820270
Molecular FormulaC16H34O2Si
Molecular Weight286.53 g/mol
Exact Mass286.23
IUPAC Namedibutoxy-methyl-(1-methylcyclohexyl)silane
SMILESCCCCO[Si](C)(OCCCC)C1(C)CCCCC1
InChIInChI=1S/C16H34O2Si/c1-5-7-14-17-19(4,18-15-8-6-2)16(3)12-10-9-11-13-16/h5-15H2,1-4H3
InChIKeyUAYJUXRDPDDJQW-UHFFFAOYSA-N
XLogP5.42
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.53
LogP ≤ 55.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 dibutoxy-methyl-(1-methylcyclohexyl)silane?
The IUPAC name of dibutoxy-methyl-(1-methylcyclohexyl)silane (CID 19820270) is dibutoxy-methyl-(1-methylcyclohexyl)silane.
What is the SMILES notation for dibutoxy-methyl-(1-methylcyclohexyl)silane?
The canonical SMILES for dibutoxy-methyl-(1-methylcyclohexyl)silane is CCCCO[Si](C)(OCCCC)C1(C)CCCCC1.
What is the InChIKey of dibutoxy-methyl-(1-methylcyclohexyl)silane?
The InChIKey is UAYJUXRDPDDJQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O2Si/c1-5-7-14-17-19(4,18-15-8-6-2)16(3)12-10-9-11-13-16/h5-15H2,1-4H3.
What are the key properties of dibutoxy-methyl-(1-methylcyclohexyl)silane?
dibutoxy-methyl-(1-methylcyclohexyl)silane has a molecular weight of 286.53 g/mol, XLogP of 5.42, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dibutoxy-methyl-(1-methylcyclohexyl)silane is sourced from PubChem (CID 19820270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).