trimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane

C14H23F3OSi3 — CID 164684946

IUPACtrimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane
SMILESC[Si](C)(C)[Si]1([Si](C)(C)C)OCc2cc(C(F)(F)F)ccc21
InChIInChI=1S/C14H23F3OSi3/c1-19(2,3)21(20(4,5)6)13-8-7-12(14(15,16)17)9-11(13)10-18-21/h7-9H,10H2,1-6H3
InChIKeyWFZUMKYAPKNYMR-UHFFFAOYSA-N
MW348.59 g/mol
LogP4.22
Rot. Bonds2

About trimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane

trimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane (PubChem CID 164684946) has the molecular formula C14H23F3OSi3 and a molecular weight of 348.59 g/mol. Its IUPAC name is trimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane.

Molecular Properties

Compound Nametrimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane
PubChem CID164684946
Molecular FormulaC14H23F3OSi3
Molecular Weight348.59 g/mol
Exact Mass348.10
IUPAC Nametrimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane
SMILESC[Si](C)(C)[Si]1([Si](C)(C)C)OCc2cc(C(F)(F)F)ccc21
InChIInChI=1S/C14H23F3OSi3/c1-19(2,3)21(20(4,5)6)13-8-7-12(14(15,16)17)9-11(13)10-18-21/h7-9H,10H2,1-6H3
InChIKeyWFZUMKYAPKNYMR-UHFFFAOYSA-N
XLogP4.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.59
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,1-Dimethyl-1,3-dihydrobenzo[c][1,2]oxasilole
CID 13085174
Silane, triethyl(phenylmethoxy)-
CID 563229
Triethylsilyloxymethyl-4-fluorobenzene
CID 11107483
tert-Butyl(4-fluorobenzyloxy)dimethylsilane
CID 13861700
Silane, (1,1-dimethylethyl)dimethyl(phenylmethoxy)-
CID 596642
2-Fluorobenzyl alcohol, tert-butyldimethylsilyl ether
CID 91728155
Trimethyl-[1-[3-(trifluoromethyl)phenyl]ethenoxy]silane
CID 11065180
tert-Butyldimethyl((4-(trifluoromethyl)benzyl)oxy)silane
CID 11277728
Dimethyl-prop-2-enyl-[[4-(trifluoromethyl)phenyl]methoxy]silane
CID 11666259
Triethyl-[[4-(trifluoromethyl)phenyl]methoxy]silane
CID 56970310
Fluoro-[[fluoro(dimethyl)silyl]oxy-phenylmethyl]-dimethylsilane
CID 86186484
(2,2-Difluoro-1-phenylethenoxy)-triethylsilane
CID 86202288

Frequently Asked Questions

What is the IUPAC name of trimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane?
The IUPAC name of trimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane (CID 164684946) is trimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane.
What is the SMILES notation for trimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane?
The canonical SMILES for trimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane is C[Si](C)(C)[Si]1([Si](C)(C)C)OCc2cc(C(F)(F)F)ccc21.
What is the InChIKey of trimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane?
The InChIKey is WFZUMKYAPKNYMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F3OSi3/c1-19(2,3)21(20(4,5)6)13-8-7-12(14(15,16)17)9-11(13)10-18-21/h7-9H,10H2,1-6H3.
What are the key properties of trimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane?
trimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane has a molecular weight of 348.59 g/mol, XLogP of 4.22, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[5-(trifluoromethyl)-1-trimethylsilyl-3H-2,1-benzoxasilol-1-yl]silane is sourced from PubChem (CID 164684946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).