dimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane

C12H28O2Si — CID 91698388

IUPACdimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane
SMILESCC(C)CCCO[Si](C)(C)OCC(C)C
InChIInChI=1S/C12H28O2Si/c1-11(2)8-7-9-13-15(5,6)14-10-12(3)4/h11-12H,7-10H2,1-6H3
InChIKeyAPBONGGYSRFRTN-UHFFFAOYSA-N
MW232.44 g/mol
LogP3.81
Rot. Bonds8

About dimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane

dimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane (PubChem CID 91698388) has the molecular formula C12H28O2Si and a molecular weight of 232.44 g/mol. Its IUPAC name is dimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane.

Molecular Properties

Compound Namedimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane
PubChem CID91698388
Molecular FormulaC12H28O2Si
Molecular Weight232.44 g/mol
Exact Mass232.19
IUPAC Namedimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane
SMILESCC(C)CCCO[Si](C)(C)OCC(C)C
InChIInChI=1S/C12H28O2Si/c1-11(2)8-7-9-13-15(5,6)14-10-12(3)4/h11-12H,7-10H2,1-6H3
InChIKeyAPBONGGYSRFRTN-UHFFFAOYSA-N
XLogP3.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.44
LogP ≤ 53.81
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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Related Compounds

Silane, (isopentyloxy)trimethyl-
CID 519534
Dipentyloxydimethylsilane
CID 525750
Silane, (isohexyloxy)trimethyl-
CID 558059
(2-Ethylbutoxy)(trimethyl)silane
CID 554481
Silane, dimethyldi(2-ethylbutoxy)-
CID 85694059
Silane, dimethyl(2,2,3,3,4,4,5,5-octafluoropentyloxy)isohexyloxy-
CID 91698245
Silane, trimethyl(2-methylbutoxy)-
CID 554470
4-Methyl-2-pentanol, TMS derivative
CID 13860854
Dimethyl[bis(3-methylbutoxy)]silane
CID 14619508
2-Methyl-1-pentanol, tert-butyldimethylsilyl ether
CID 86203641
tert-butyl-dimethyl-[(3S)-3-methylpentoxy]silane
CID 88988001
Trimethyl-[2-(trimethylsilyloxymethyl)pentoxy]silane
CID 134895252

Frequently Asked Questions

What is the IUPAC name of dimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane?
The IUPAC name of dimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane (CID 91698388) is dimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane.
What is the SMILES notation for dimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane?
The canonical SMILES for dimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane is CC(C)CCCO[Si](C)(C)OCC(C)C.
What is the InChIKey of dimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane?
The InChIKey is APBONGGYSRFRTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O2Si/c1-11(2)8-7-9-13-15(5,6)14-10-12(3)4/h11-12H,7-10H2,1-6H3.
What are the key properties of dimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane?
dimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane has a molecular weight of 232.44 g/mol, XLogP of 3.81, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(4-methylpentoxy)-(2-methylpropoxy)silane is sourced from PubChem (CID 91698388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).