hexan-2-yloxy-dimethyl-(4-methylpentoxy)silane

C14H32O2Si — CID 91733280

IUPAChexan-2-yloxy-dimethyl-(4-methylpentoxy)silane
SMILESCCCCC(C)O[Si](C)(C)OCCCC(C)C
InChIInChI=1S/C14H32O2Si/c1-7-8-11-14(4)16-17(5,6)15-12-9-10-13(2)3/h13-14H,7-12H2,1-6H3
InChIKeyDIRTZKQBYXTREI-UHFFFAOYSA-N
MW260.49 g/mol
LogP4.74
Rot. Bonds10

About hexan-2-yloxy-dimethyl-(4-methylpentoxy)silane

hexan-2-yloxy-dimethyl-(4-methylpentoxy)silane (PubChem CID 91733280) has the molecular formula C14H32O2Si and a molecular weight of 260.49 g/mol. Its IUPAC name is hexan-2-yloxy-dimethyl-(4-methylpentoxy)silane.

Molecular Properties

Compound Namehexan-2-yloxy-dimethyl-(4-methylpentoxy)silane
PubChem CID91733280
Molecular FormulaC14H32O2Si
Molecular Weight260.49 g/mol
Exact Mass260.22
IUPAC Namehexan-2-yloxy-dimethyl-(4-methylpentoxy)silane
SMILESCCCCC(C)O[Si](C)(C)OCCCC(C)C
InChIInChI=1S/C14H32O2Si/c1-7-8-11-14(4)16-17(5,6)15-12-9-10-13(2)3/h13-14H,7-12H2,1-6H3
InChIKeyDIRTZKQBYXTREI-UHFFFAOYSA-N
XLogP4.74
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 ≤ 54.74
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

4-Methyl-2-pentanol, TMS derivative
CID 13860854
Silane, dimethyldi(3-methylpentyloxy)-
CID 14388494
Dimethylpyrrolbis[(2-methylpentyl)oxy]morphosilane
CID 91697347
Silane, dimethylisobutoxyisohexyloxy-
CID 91698388
Silane, dimethyl(3-heptyloxy)isohexyloxy-
CID 91698390
Silane, dimethyl(2-methylbutoxy)isohexyloxy-
CID 91698394
Silane, diethyl(3,3-dimethylbut-2-yloxy)isohexyloxy-
CID 91698395
Silane, dimethyldiisohexyloxy-
CID 91698398
Silane, dimethyl(3-methylpentyloxy)isohexyloxy-
CID 91698399
Silane, diethylisohexyloxy(2-methylbutoxy)-
CID 91698400
Silane, diethylisohexyloxy(4-methylpent-2-yloxy)-
CID 91698408
Silane, diethylisohexyloxy(4-octyloxy)-
CID 91698414

Frequently Asked Questions

What is the IUPAC name of hexan-2-yloxy-dimethyl-(4-methylpentoxy)silane?
The IUPAC name of hexan-2-yloxy-dimethyl-(4-methylpentoxy)silane (CID 91733280) is hexan-2-yloxy-dimethyl-(4-methylpentoxy)silane.
What is the SMILES notation for hexan-2-yloxy-dimethyl-(4-methylpentoxy)silane?
The canonical SMILES for hexan-2-yloxy-dimethyl-(4-methylpentoxy)silane is CCCCC(C)O[Si](C)(C)OCCCC(C)C.
What is the InChIKey of hexan-2-yloxy-dimethyl-(4-methylpentoxy)silane?
The InChIKey is DIRTZKQBYXTREI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O2Si/c1-7-8-11-14(4)16-17(5,6)15-12-9-10-13(2)3/h13-14H,7-12H2,1-6H3.
What are the key properties of hexan-2-yloxy-dimethyl-(4-methylpentoxy)silane?
hexan-2-yloxy-dimethyl-(4-methylpentoxy)silane has a molecular weight of 260.49 g/mol, XLogP of 4.74, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hexan-2-yloxy-dimethyl-(4-methylpentoxy)silane is sourced from PubChem (CID 91733280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).