(1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane

C12H27BrOSi — CID 87488521

IUPAC(1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane
SMILESCCCCCCO[Si](C)(C)C(C)(C)CBr
InChIInChI=1S/C12H27BrOSi/c1-6-7-8-9-10-14-15(4,5)12(2,3)11-13/h6-11H2,1-5H3
InChIKeyIVGSYOXJYCUYAM-UHFFFAOYSA-N
MW295.34 g/mol
LogP4.96
Rot. Bonds8

About (1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane

(1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane (PubChem CID 87488521) has the molecular formula C12H27BrOSi and a molecular weight of 295.34 g/mol. Its IUPAC name is (1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane.

Molecular Properties

Compound Name(1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane
PubChem CID87488521
Molecular FormulaC12H27BrOSi
Molecular Weight295.34 g/mol
Exact Mass294.10
IUPAC Name(1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane
SMILESCCCCCCO[Si](C)(C)C(C)(C)CBr
InChIInChI=1S/C12H27BrOSi/c1-6-7-8-9-10-14-15(4,5)12(2,3)11-13/h6-11H2,1-5H3
InChIKeyIVGSYOXJYCUYAM-UHFFFAOYSA-N
XLogP4.96
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(1-bromo-2-methylpropan-2-yl)-dimethyl-propoxysilane
CID 57251178
tert-butyl-hexacosoxy-dimethylsilane
CID 6430213
butoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane
CID 88521486
tert-butyl-dimethyl-[(Z)-tetracos-15-enoxy]silane
CID 6430267
tert-butyl-[(Z)-icos-5-enoxy]-dimethylsilane
CID 6430269
tert-butyl-dimethyl-[(E)-octadec-6-enoxy]silane
CID 6430282
triheptoxy(methyl)silane
CID 525768
hexoxy-dimethyl-nonoxysilane
CID 91741085
tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxypentoxy]-dimethylsilane
CID 529127
tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxyhexoxy]-dimethylsilane
CID 6430202
tri(icosoxy)-methylsilane
CID 163923848
tert-butyl-[10-[tert-butyl(dimethyl)silyl]oxydecoxy]-dimethylsilane
CID 6430197

Frequently Asked Questions

What is the IUPAC name of (1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane?
The IUPAC name of (1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane (CID 87488521) is (1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane.
What is the SMILES notation for (1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane?
The canonical SMILES for (1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane is CCCCCCO[Si](C)(C)C(C)(C)CBr.
What is the InChIKey of (1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane?
The InChIKey is IVGSYOXJYCUYAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27BrOSi/c1-6-7-8-9-10-14-15(4,5)12(2,3)11-13/h6-11H2,1-5H3.
What are the key properties of (1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane?
(1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane has a molecular weight of 295.34 g/mol, XLogP of 4.96, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-bromo-2-methylpropan-2-yl)-hexoxy-dimethylsilane is sourced from PubChem (CID 87488521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).