1,1,2-trimethoxy-3-propoxy-2-propylsilinane

C14H30O4Si — CID 174684836

IUPAC1,1,2-trimethoxy-3-propoxy-2-propylsilinane
SMILESCCCOC1CCC[Si](OC)(OC)C1(CCC)OC
InChIInChI=1S/C14H30O4Si/c1-6-10-14(15-3)13(18-11-7-2)9-8-12-19(14,16-4)17-5/h13H,6-12H2,1-5H3
InChIKeyZAZXBXZVOITMKX-UHFFFAOYSA-N
MW290.48 g/mol
LogP3.03
Rot. Bonds8

About 1,1,2-trimethoxy-3-propoxy-2-propylsilinane

1,1,2-trimethoxy-3-propoxy-2-propylsilinane (PubChem CID 174684836) has the molecular formula C14H30O4Si and a molecular weight of 290.48 g/mol. Its IUPAC name is 1,1,2-trimethoxy-3-propoxy-2-propylsilinane.

Molecular Properties

Compound Name1,1,2-trimethoxy-3-propoxy-2-propylsilinane
PubChem CID174684836
Molecular FormulaC14H30O4Si
Molecular Weight290.48 g/mol
Exact Mass290.19
IUPAC Name1,1,2-trimethoxy-3-propoxy-2-propylsilinane
SMILESCCCOC1CCC[Si](OC)(OC)C1(CCC)OC
InChIInChI=1S/C14H30O4Si/c1-6-10-14(15-3)13(18-11-7-2)9-8-12-19(14,16-4)17-5/h13H,6-12H2,1-5H3
InChIKeyZAZXBXZVOITMKX-UHFFFAOYSA-N
XLogP3.03
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.48
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

Tert-butyl-dimethyl-(oxan-2-ylmethoxy)silane
CID 54753890
1,1,2-Trimethoxy-2-propyl-3-(trifluoromethoxy)silinane
CID 174902298
tri(propan-2-yl)-[[(3R)-3,4,5,6-tetrahydro-2H-pyran-2-ylium-3-yl]oxy]silane
CID 135045683
2,2-Dimethyl-6-[2-(oxiran-2-ylmethoxy)butyl]oxasilinane
CID 88454660
(2-Ethyloxan-3-yl)oxy-trimethylsilane
CID 90696455
Trimethyl-[2-(oxan-2-ylmethoxy)ethyl]silane
CID 91175172
Dimethoxy-methyl-[3-(oxiran-2-ylmethoxy)octyl]silane
CID 140874787
Trimethoxy-[4-(oxiran-2-ylmethoxy)octyl]silane
CID 152146423
Trimethyl(oxan-2-ylmethoxy)silane
CID 172194117
tert-butyl-dimethyl-[[(2S)-oxan-2-yl]methoxy]silane
CID 173794813
1,1,2-Triethoxy-2-ethylsilinane
CID 174278517
2-Methyloxirane;1,1,2-trimethoxy-2-propylsilinane
CID 174287972

Frequently Asked Questions

What is the IUPAC name of 1,1,2-trimethoxy-3-propoxy-2-propylsilinane?
The IUPAC name of 1,1,2-trimethoxy-3-propoxy-2-propylsilinane (CID 174684836) is 1,1,2-trimethoxy-3-propoxy-2-propylsilinane.
What is the SMILES notation for 1,1,2-trimethoxy-3-propoxy-2-propylsilinane?
The canonical SMILES for 1,1,2-trimethoxy-3-propoxy-2-propylsilinane is CCCOC1CCC[Si](OC)(OC)C1(CCC)OC.
What is the InChIKey of 1,1,2-trimethoxy-3-propoxy-2-propylsilinane?
The InChIKey is ZAZXBXZVOITMKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O4Si/c1-6-10-14(15-3)13(18-11-7-2)9-8-12-19(14,16-4)17-5/h13H,6-12H2,1-5H3.
What are the key properties of 1,1,2-trimethoxy-3-propoxy-2-propylsilinane?
1,1,2-trimethoxy-3-propoxy-2-propylsilinane has a molecular weight of 290.48 g/mol, XLogP of 3.03, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2-trimethoxy-3-propoxy-2-propylsilinane is sourced from PubChem (CID 174684836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).