chloroethane;1,1,2-trimethoxy-2-propylsilinane

C13H29ClO3Si — CID 174406233

IUPACchloroethane;1,1,2-trimethoxy-2-propylsilinane
SMILESCCCC1(OC)CCCC[Si]1(OC)OC.CCCl
InChIInChI=1S/C11H24O3Si.C2H5Cl/c1-5-8-11(12-2)9-6-7-10-15(11,13-3)14-4;1-2-3/h5-10H2,1-4H3;2H2,1H3
InChIKeyUOGFQQPEAXGWMK-UHFFFAOYSA-N
MW296.91 g/mol
LogP3.87
Rot. Bonds5

About chloroethane;1,1,2-trimethoxy-2-propylsilinane

chloroethane;1,1,2-trimethoxy-2-propylsilinane (PubChem CID 174406233) has the molecular formula C13H29ClO3Si and a molecular weight of 296.91 g/mol. Its IUPAC name is chloroethane;1,1,2-trimethoxy-2-propylsilinane.

Molecular Properties

Compound Namechloroethane;1,1,2-trimethoxy-2-propylsilinane
PubChem CID174406233
Molecular FormulaC13H29ClO3Si
Molecular Weight296.91 g/mol
Exact Mass296.16
IUPAC Namechloroethane;1,1,2-trimethoxy-2-propylsilinane
SMILESCCCC1(OC)CCCC[Si]1(OC)OC.CCCl
InChIInChI=1S/C11H24O3Si.C2H5Cl/c1-5-8-11(12-2)9-6-7-10-15(11,13-3)14-4;1-2-3/h5-10H2,1-4H3;2H2,1H3
InChIKeyUOGFQQPEAXGWMK-UHFFFAOYSA-N
XLogP3.87
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.91
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethoxyethane;1,1,2-trimethoxy-2-propylsilinane
CID 174297956
imidazolidine;1,1,2-trimethoxy-2-propylsilinane
CID 174342842
hydrogen sulfite;1,1,2-trimethoxy-2-propylsilinane
CID 174790956
1-prop-1-enylsulfanylprop-1-ene;1,1,2-trimethoxy-2-propylsilinane
CID 174905238
1H-imidazole;1,1,2-trimethoxy-2-propylsilinane
CID 174851969
2-(oxiran-2-ylmethoxymethyl)oxirane;1,1,2-trimethoxy-2-propylsilinane
CID 174317269
methyl prop-2-enoate;1,1,2-trimethoxy-2-propylsilinane
CID 175374557
but-2-enamide;1,1,2-trimethoxy-2-propylsilinane
CID 174413955
N-butyl-N-[3-(1,1,2-trimethoxysilinan-2-yl)propyl]butan-1-amine
CID 174392249
3-(1,1,2-trimethoxysilinan-2-yl)propan-1-ol
CID 174434507
N-[3-(1,1,2-trimethoxysilinan-2-yl)propyl]pentan-1-amine
CID 175279525
2-(3-isothiocyanatopropyl)-1,1,2-trimethoxysilinane
CID 174434144

Frequently Asked Questions

What is the IUPAC name of chloroethane;1,1,2-trimethoxy-2-propylsilinane?
The IUPAC name of chloroethane;1,1,2-trimethoxy-2-propylsilinane (CID 174406233) is chloroethane;1,1,2-trimethoxy-2-propylsilinane.
What is the SMILES notation for chloroethane;1,1,2-trimethoxy-2-propylsilinane?
The canonical SMILES for chloroethane;1,1,2-trimethoxy-2-propylsilinane is CCCC1(OC)CCCC[Si]1(OC)OC.CCCl.
What is the InChIKey of chloroethane;1,1,2-trimethoxy-2-propylsilinane?
The InChIKey is UOGFQQPEAXGWMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O3Si.C2H5Cl/c1-5-8-11(12-2)9-6-7-10-15(11,13-3)14-4;1-2-3/h5-10H2,1-4H3;2H2,1H3.
What are the key properties of chloroethane;1,1,2-trimethoxy-2-propylsilinane?
chloroethane;1,1,2-trimethoxy-2-propylsilinane has a molecular weight of 296.91 g/mol, XLogP of 3.87, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for chloroethane;1,1,2-trimethoxy-2-propylsilinane is sourced from PubChem (CID 174406233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).