ethyl-dimethoxy-(2-nonoxypentoxy)silane

C18H40O4Si — CID 141205041

IUPACethyl-dimethoxy-(2-nonoxypentoxy)silane
SMILESCCCCCCCCCOC(CCC)CO[Si](CC)(OC)OC
InChIInChI=1S/C18H40O4Si/c1-6-9-10-11-12-13-14-16-21-18(15-7-2)17-22-23(8-3,19-4)20-5/h18H,6-17H2,1-5H3
InChIKeyJYBOSKDUYDPWAN-UHFFFAOYSA-N
MW348.60 g/mol
LogP5.19
Rot. Bonds17

About ethyl-dimethoxy-(2-nonoxypentoxy)silane

ethyl-dimethoxy-(2-nonoxypentoxy)silane (PubChem CID 141205041) has the molecular formula C18H40O4Si and a molecular weight of 348.60 g/mol. Its IUPAC name is ethyl-dimethoxy-(2-nonoxypentoxy)silane.

Molecular Properties

Compound Nameethyl-dimethoxy-(2-nonoxypentoxy)silane
PubChem CID141205041
Molecular FormulaC18H40O4Si
Molecular Weight348.60 g/mol
Exact Mass348.27
IUPAC Nameethyl-dimethoxy-(2-nonoxypentoxy)silane
SMILESCCCCCCCCCOC(CCC)CO[Si](CC)(OC)OC
InChIInChI=1S/C18H40O4Si/c1-6-9-10-11-12-13-14-16-21-18(15-7-2)17-22-23(8-3,19-4)20-5/h18H,6-17H2,1-5H3
InChIKeyJYBOSKDUYDPWAN-UHFFFAOYSA-N
XLogP5.19
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds17
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.60
LogP ≤ 55.19
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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Related Compounds

1-[(2S)-2-octadecoxypentoxy]octadecane
CID 173435478
1-(2-dodecoxydecoxy)dodecane
CID 175347971
ethyl-(2-ethylhexoxy)-dimethoxysilane
CID 175827812
6-octoxyundecane
CID 20520524
10-decoxyicosane
CID 150196888
1-methoxy-10-(4-octoxy-2-pentoxybutoxy)decane
CID 102089285
1-[2,3-di(tridecoxy)propoxy]tridecane
CID 71331054
1-[2,3-di(octacosoxy)propoxy]octacosane
CID 139785017
(2S)-3-methoxy-2-octadecoxypropan-1-ol
CID 22837281
ethyl-methoxy-dipentoxysilane;ethylsilane
CID 157076319
1-pentan-3-yloxydecane
CID 173279604
decoxy-diethyl-heptan-4-yloxysilane
CID 91742826

Frequently Asked Questions

What is the IUPAC name of ethyl-dimethoxy-(2-nonoxypentoxy)silane?
The IUPAC name of ethyl-dimethoxy-(2-nonoxypentoxy)silane (CID 141205041) is ethyl-dimethoxy-(2-nonoxypentoxy)silane.
What is the SMILES notation for ethyl-dimethoxy-(2-nonoxypentoxy)silane?
The canonical SMILES for ethyl-dimethoxy-(2-nonoxypentoxy)silane is CCCCCCCCCOC(CCC)CO[Si](CC)(OC)OC.
What is the InChIKey of ethyl-dimethoxy-(2-nonoxypentoxy)silane?
The InChIKey is JYBOSKDUYDPWAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H40O4Si/c1-6-9-10-11-12-13-14-16-21-18(15-7-2)17-22-23(8-3,19-4)20-5/h18H,6-17H2,1-5H3.
What are the key properties of ethyl-dimethoxy-(2-nonoxypentoxy)silane?
ethyl-dimethoxy-(2-nonoxypentoxy)silane has a molecular weight of 348.60 g/mol, XLogP of 5.19, 17 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-dimethoxy-(2-nonoxypentoxy)silane is sourced from PubChem (CID 141205041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).