butyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane

C15H32O2Si — CID 86200737

IUPACbutyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane
SMILESCCCC[Si](C)(C)CCCCOC1CCCCO1
InChIInChI=1S/C15H32O2Si/c1-4-5-13-18(2,3)14-9-8-12-17-15-10-6-7-11-16-15/h15H,4-14H2,1-3H3
InChIKeyYCXDYDCRXFXRHU-UHFFFAOYSA-N
MW272.50 g/mol
LogP4.82
Rot. Bonds9

About butyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane

butyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane (PubChem CID 86200737) has the molecular formula C15H32O2Si and a molecular weight of 272.50 g/mol. Its IUPAC name is butyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane.

Molecular Properties

Compound Namebutyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane
PubChem CID86200737
Molecular FormulaC15H32O2Si
Molecular Weight272.50 g/mol
Exact Mass272.22
IUPAC Namebutyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane
SMILESCCCC[Si](C)(C)CCCCOC1CCCCO1
InChIInChI=1S/C15H32O2Si/c1-4-5-13-18(2,3)14-9-8-12-17-15-10-6-7-11-16-15/h15H,4-14H2,1-3H3
InChIKeyYCXDYDCRXFXRHU-UHFFFAOYSA-N
XLogP4.82
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.50
LogP ≤ 54.82
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 butyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane?
The IUPAC name of butyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane (CID 86200737) is butyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane.
What is the SMILES notation for butyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane?
The canonical SMILES for butyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane is CCCC[Si](C)(C)CCCCOC1CCCCO1.
What is the InChIKey of butyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane?
The InChIKey is YCXDYDCRXFXRHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O2Si/c1-4-5-13-18(2,3)14-9-8-12-17-15-10-6-7-11-16-15/h15H,4-14H2,1-3H3.
What are the key properties of butyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane?
butyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane has a molecular weight of 272.50 g/mol, XLogP of 4.82, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-dimethyl-[4-(oxan-2-yloxy)butyl]silane is sourced from PubChem (CID 86200737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).