triethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane

C19H34O5Si2 — CID 164960790

IUPACtriethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane
SMILESCCC[Si]1(C)OCc2cc(CC[Si](OCC)(OCC)OCC)ccc2O1
InChIInChI=1S/C19H34O5Si2/c1-6-13-25(5)23-16-18-15-17(10-11-19(18)24-25)12-14-26(20-7-2,21-8-3)22-9-4/h10-11,15H,6-9,12-14,16H2,1-5H3
InChIKeyOBMJSOHUAZMBHD-UHFFFAOYSA-N
MW398.65 g/mol
LogP4.67
Rot. Bonds11

About triethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane

triethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane (PubChem CID 164960790) has the molecular formula C19H34O5Si2 and a molecular weight of 398.65 g/mol. Its IUPAC name is triethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane.

Molecular Properties

Compound Nametriethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane
PubChem CID164960790
Molecular FormulaC19H34O5Si2
Molecular Weight398.65 g/mol
Exact Mass398.19
IUPAC Nametriethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane
SMILESCCC[Si]1(C)OCc2cc(CC[Si](OCC)(OCC)OCC)ccc2O1
InChIInChI=1S/C19H34O5Si2/c1-6-13-25(5)23-16-18-15-17(10-11-19(18)24-25)12-14-26(20-7-2,21-8-3)22-9-4/h10-11,15H,6-9,12-14,16H2,1-5H3
InChIKeyOBMJSOHUAZMBHD-UHFFFAOYSA-N
XLogP4.67
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.65
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N,N-dimethyl-3-[2-methyl-6-(3-triethoxysilylpropyl)-4H-1,3,2-benzodioxasilin-2-yl]propan-1-amine
CID 164815656
3-(2,2-diphenyl-4H-1,3,2-benzodioxasilin-6-yl)propyl-triethoxysilane
CID 164816168
trichloro-[2-[2-(chloromethyl)-2-methyl-4H-1,3,2-benzodioxasilin-6-yl]ethyl]silane
CID 164816052
3-[2-methyl-6-(2-triethoxysilylethoxy)-4H-1,3,2-benzodioxasilin-2-yl]propyl prop-2-enoate
CID 164816291
[diacetyloxy-[2-(2,2-diphenyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silyl] acetate
CID 164816174
[diacetyloxy-[[2-(3-aminopropyl)-2-methyl-4H-1,3,2-benzodioxasilin-6-yl]oxymethyl]silyl] acetate;[diacetyloxy-[[2-[3-(dimethylamino)propyl]-2-methyl-4H-1,3,2-benzodioxasilin-6-yl]oxymethyl]silyl] acetate;[diacetyloxy-[(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)oxymethyl]silyl] acetate;[diacetyloxy-[[2-methyl-2-(3-sulfanylpropyl)-4H-1,3,2-benzodioxasilin-6-yl]oxymethyl]silyl] acetate;N,N-dimethyl-3-[2-methyl-6-(trichlorosilylmethoxy)-4H-1,3,2-benzodioxasilin-2-yl]propan-1-amine;N,N-dimethyl-3-[2-methyl-6-(triethoxysilylmethoxy)-4H-1,3,2-benzodioxasilin-2-yl]propan-1-amine;N,N-dimethyl-3-[2-methyl-6-(trimethoxysilylmethoxy)-4H-1,3,2-benzodioxasilin-2-yl]propan-1-amine;3-[2-methyl-6-(trichlorosilylmethoxy)-4H-1,3,2-benzodioxasilin-2-yl]propan-1-amine;3-[2-methyl-6-(trichlorosilylmethoxy)-4H-1,3,2-benzodioxasilin-2-yl]propane-1-thiol;bis(3-[2-methyl-6-(triethoxysilylmethoxy)-4H-1,3,2-benzodioxasilin-2-yl]propan-1-amine);bis(3-[2-methyl-6-(trimethoxysilylmethoxy)-4H-1,3,2-benzodioxasilin-2-yl]propan-1-amine);trichloro-[(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)oxymethyl]silane;triethoxy-[(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)oxymethyl]silane;trimethoxy-[(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)oxymethyl]silane
CID 165076222
[diacetyloxy-[2-(3-aminopropyl)-2-methyl-4H-1,3,2-benzodioxasilin-6-yl]silyl] acetate;[diacetyloxy-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)silyl] acetate;N,N-dimethyl-3-(2-methyl-6-trimethoxysilyl-4H-1,3,2-benzodioxasilin-2-yl)propan-1-amine;3-(2-methyl-6-trichlorosilyl-4H-1,3,2-benzodioxasilin-2-yl)propan-1-amine;3-(2-methyl-6-triethoxysilyl-4H-1,3,2-benzodioxasilin-2-yl)propan-1-amine;3-(2-methyl-6-trimethoxysilyl-4H-1,3,2-benzodioxasilin-2-yl)propan-1-amine;trichloro-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)silane;triethoxy-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)silane;trimethoxy-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)silane
CID 165069154
trichloro-[3-(2-cyclohexyl-2-methyl-4H-1,3,2-benzodioxasilin-6-yl)propyl]silane
CID 164816092
triethoxy-[2-(1H-pyrrol-3-yl)ethyl]silane
CID 174857593
2-[4-(1-bromoethyl)phenyl]ethyl-triethoxysilane
CID 66846155
[diacetyloxy-[2-[[2-(chloromethyl)-2-methyl-4H-1,3,2-benzodioxasilin-6-yl]oxy]ethyl]silyl] acetate
CID 164815704
[diacetyloxy-[2-(2,2-diphenyl-4H-1,3-benzodioxin-6-yl)ethyl]silyl] acetate;[diacetyloxy-[2-(2-methyl-2-phenyl-4H-1,3-benzodioxin-6-yl)ethyl]silyl] acetate;2-(2,2-diphenyl-4H-1,3-benzodioxin-6-yl)ethyl-triethoxysilane;2-(2,2-diphenyl-4H-1,3-benzodioxin-6-yl)ethyl-trimethoxysilane;trichloro-[2-(2,2-diphenyl-4H-1,3-benzodioxin-6-yl)ethyl]silane;trichloro-[2-(2-methyl-2-phenyl-4H-1,3-benzodioxin-6-yl)ethyl]silane;triethoxy-[2-(2-methyl-2-phenyl-4H-1,3-benzodioxin-6-yl)ethyl]silane;trimethoxy-[2-(2-methyl-2-phenyl-4H-1,3-benzodioxin-6-yl)ethyl]silane
CID 165031551

Frequently Asked Questions

What is the IUPAC name of triethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane?
The IUPAC name of triethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane (CID 164960790) is triethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane.
What is the SMILES notation for triethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane?
The canonical SMILES for triethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane is CCC[Si]1(C)OCc2cc(CC[Si](OCC)(OCC)OCC)ccc2O1.
What is the InChIKey of triethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane?
The InChIKey is OBMJSOHUAZMBHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34O5Si2/c1-6-13-25(5)23-16-18-15-17(10-11-19(18)24-25)12-14-26(20-7-2,21-8-3)22-9-4/h10-11,15H,6-9,12-14,16H2,1-5H3.
What are the key properties of triethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane?
triethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane has a molecular weight of 398.65 g/mol, XLogP of 4.67, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[2-(2-methyl-2-propyl-4H-1,3,2-benzodioxasilin-6-yl)ethyl]silane is sourced from PubChem (CID 164960790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).