dodecoxy-diethyl-(2-methylpentan-3-yloxy)silane

C22H48O2Si — CID 91743320

IUPACdodecoxy-diethyl-(2-methylpentan-3-yloxy)silane
SMILESCCCCCCCCCCCCO[Si](CC)(CC)OC(CC)C(C)C
InChIInChI=1S/C22H48O2Si/c1-7-11-12-13-14-15-16-17-18-19-20-23-25(9-3,10-4)24-22(8-2)21(5)6/h21-22H,7-20H2,1-6H3
InChIKeyGWKADEZEWBDVCF-UHFFFAOYSA-N
MW372.71 g/mol
LogP7.86
Rot. Bonds18

About dodecoxy-diethyl-(2-methylpentan-3-yloxy)silane

dodecoxy-diethyl-(2-methylpentan-3-yloxy)silane (PubChem CID 91743320) has the molecular formula C22H48O2Si and a molecular weight of 372.71 g/mol. Its IUPAC name is dodecoxy-diethyl-(2-methylpentan-3-yloxy)silane.

Molecular Properties

Compound Namedodecoxy-diethyl-(2-methylpentan-3-yloxy)silane
PubChem CID91743320
Molecular FormulaC22H48O2Si
Molecular Weight372.71 g/mol
Exact Mass372.34
IUPAC Namedodecoxy-diethyl-(2-methylpentan-3-yloxy)silane
SMILESCCCCCCCCCCCCO[Si](CC)(CC)OC(CC)C(C)C
InChIInChI=1S/C22H48O2Si/c1-7-11-12-13-14-15-16-17-18-19-20-23-25(9-3,10-4)24-22(8-2)21(5)6/h21-22H,7-20H2,1-6H3
InChIKeyGWKADEZEWBDVCF-UHFFFAOYSA-N
XLogP7.86
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds18
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.71
LogP ≤ 57.86
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, (1,1-dimethylethyl)dimethyl[(1-methylheptyl)oxy]-
CID 6430238
Silane, dimethyldi(2-ethylhexyloxy)
CID 85694064
Silane, dimethyldi(2-octyloxy)-
CID 85708223
1,10-decanediol, tBDMS
CID 6430197
2-nonanol, tBDMS
CID 6430237
1,8-octanediol, tBDMS
CID 6430203
tert-butyl-dimethyl-[(3S)-3-methylundecoxy]silane
CID 11312646
(s)-t-Butyl(dimethyl)[(13-methylheptadecyl)oxy]silane
CID 146679947
Ethyl-(3-fluoro-2-methyldecan-2-yl)oxy-di(propan-2-yloxy)silane
CID 140230149
1-Fluoroicosan-8-yloxy-methoxy-methyl-propylsilane
CID 141458490
Ethoxy-(8-fluorooctyl)-methyl-pentadecan-2-yloxysilane
CID 149956655
Ethoxy-ethyl-(8-fluorooctyl)-pentadecan-2-yloxysilane
CID 152723847

Frequently Asked Questions

What is the IUPAC name of dodecoxy-diethyl-(2-methylpentan-3-yloxy)silane?
The IUPAC name of dodecoxy-diethyl-(2-methylpentan-3-yloxy)silane (CID 91743320) is dodecoxy-diethyl-(2-methylpentan-3-yloxy)silane.
What is the SMILES notation for dodecoxy-diethyl-(2-methylpentan-3-yloxy)silane?
The canonical SMILES for dodecoxy-diethyl-(2-methylpentan-3-yloxy)silane is CCCCCCCCCCCCO[Si](CC)(CC)OC(CC)C(C)C.
What is the InChIKey of dodecoxy-diethyl-(2-methylpentan-3-yloxy)silane?
The InChIKey is GWKADEZEWBDVCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H48O2Si/c1-7-11-12-13-14-15-16-17-18-19-20-23-25(9-3,10-4)24-22(8-2)21(5)6/h21-22H,7-20H2,1-6H3.
What are the key properties of dodecoxy-diethyl-(2-methylpentan-3-yloxy)silane?
dodecoxy-diethyl-(2-methylpentan-3-yloxy)silane has a molecular weight of 372.71 g/mol, XLogP of 7.86, 18 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dodecoxy-diethyl-(2-methylpentan-3-yloxy)silane is sourced from PubChem (CID 91743320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).