dihexyl dimethyl silicate

C14H32O4Si — CID 524720

IUPACdihexyl dimethyl silicate
SMILESCCCCCCO[Si](OC)(OC)OCCCCCC
InChIInChI=1S/C14H32O4Si/c1-5-7-9-11-13-17-19(15-3,16-4)18-14-12-10-8-6-2/h5-14H2,1-4H3
InChIKeyNVQRIFCDXHUCPX-UHFFFAOYSA-N
MW292.49 g/mol
LogP3.91
Rot. Bonds14

About dihexyl dimethyl silicate

dihexyl dimethyl silicate (PubChem CID 524720) has the molecular formula C14H32O4Si and a molecular weight of 292.49 g/mol. Its IUPAC name is dihexyl dimethyl silicate.

Molecular Properties

Compound Namedihexyl dimethyl silicate
PubChem CID524720
Molecular FormulaC14H32O4Si
Molecular Weight292.49 g/mol
Exact Mass292.21
IUPAC Namedihexyl dimethyl silicate
SMILESCCCCCCO[Si](OC)(OC)OCCCCCC
InChIInChI=1S/C14H32O4Si/c1-5-7-9-11-13-17-19(15-3,16-4)18-14-12-10-8-6-2/h5-14H2,1-4H3
InChIKeyNVQRIFCDXHUCPX-UHFFFAOYSA-N
XLogP3.91
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.49
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 dihexyl dimethyl silicate?
The IUPAC name of dihexyl dimethyl silicate (CID 524720) is dihexyl dimethyl silicate.
What is the SMILES notation for dihexyl dimethyl silicate?
The canonical SMILES for dihexyl dimethyl silicate is CCCCCCO[Si](OC)(OC)OCCCCCC.
What is the InChIKey of dihexyl dimethyl silicate?
The InChIKey is NVQRIFCDXHUCPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O4Si/c1-5-7-9-11-13-17-19(15-3,16-4)18-14-12-10-8-6-2/h5-14H2,1-4H3.
What are the key properties of dihexyl dimethyl silicate?
dihexyl dimethyl silicate has a molecular weight of 292.49 g/mol, XLogP of 3.91, 14 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dihexyl dimethyl silicate is sourced from PubChem (CID 524720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).