dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane

C14H32O2Si — CID 91698399

IUPACdimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane
SMILESCCC(C)CCO[Si](C)(C)OCCCC(C)C
InChIInChI=1S/C14H32O2Si/c1-7-14(4)10-12-16-17(5,6)15-11-8-9-13(2)3/h13-14H,7-12H2,1-6H3
InChIKeyZABRSOANPHAWOH-UHFFFAOYSA-N
MW260.49 g/mol
LogP4.59
Rot. Bonds10

About dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane

dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane (PubChem CID 91698399) has the molecular formula C14H32O2Si and a molecular weight of 260.49 g/mol. Its IUPAC name is dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane.

Molecular Properties

Compound Namedimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane
PubChem CID91698399
Molecular FormulaC14H32O2Si
Molecular Weight260.49 g/mol
Exact Mass260.22
IUPAC Namedimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane
SMILESCCC(C)CCO[Si](C)(C)OCCCC(C)C
InChIInChI=1S/C14H32O2Si/c1-7-14(4)10-12-16-17(5,6)15-11-8-9-13(2)3/h13-14H,7-12H2,1-6H3
InChIKeyZABRSOANPHAWOH-UHFFFAOYSA-N
XLogP4.59
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.49
LogP ≤ 54.59
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 dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane?
The IUPAC name of dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane (CID 91698399) is dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane.
What is the SMILES notation for dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane?
The canonical SMILES for dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane is CCC(C)CCO[Si](C)(C)OCCCC(C)C.
What is the InChIKey of dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane?
The InChIKey is ZABRSOANPHAWOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O2Si/c1-7-14(4)10-12-16-17(5,6)15-11-8-9-13(2)3/h13-14H,7-12H2,1-6H3.
What are the key properties of dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane?
dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane has a molecular weight of 260.49 g/mol, XLogP of 4.59, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(3-methylpentoxy)-(4-methylpentoxy)silane is sourced from PubChem (CID 91698399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).