[(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane

C11H23BrOSi — CID 11323435

IUPAC[(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane
SMILESCC[Si](CC)(CC)OC/C(C)=C/CBr
InChIInChI=1S/C11H23BrOSi/c1-5-14(6-2,7-3)13-10-11(4)8-9-12/h8H,5-7,9-10H2,1-4H3/b11-8+
InChIKeyROASVDVPMZYRSM-DHZHZOJOSA-N
MW279.29 g/mol
LogP4.35
Rot. Bonds7

About [(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane

[(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane (PubChem CID 11323435) has the molecular formula C11H23BrOSi and a molecular weight of 279.29 g/mol. Its IUPAC name is [(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane.

Molecular Properties

Compound Name[(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane
PubChem CID11323435
Molecular FormulaC11H23BrOSi
Molecular Weight279.29 g/mol
Exact Mass278.07
IUPAC Name[(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane
SMILESCC[Si](CC)(CC)OC/C(C)=C/CBr
InChIInChI=1S/C11H23BrOSi/c1-5-14(6-2,7-3)13-10-11(4)8-9-12/h8H,5-7,9-10H2,1-4H3/b11-8+
InChIKeyROASVDVPMZYRSM-DHZHZOJOSA-N
XLogP4.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.29
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Tert-butyldimethyl((3-methylbut-2-en-1-yl)oxy)silane
CID 11469722
(Z)-(4-bromobut-2-enyloxy)(tert-butyl)dimethylsilane
CID 10999946
1-Dimethylisopropylsilyloxy-3-methylbut-2-ene
CID 531285
Prenol, TMS derivative
CID 6421205
((2-(Bromomethyl)allyl)oxy)(tert-butyl)dimethylsilane
CID 10923433
[(E)-4-bromobut-2-enoxy]-tert-butyl-dimethylsilane
CID 11254102
[(Z)-4-bromo-3-fluoro-2-methylbut-2-enoxy]-tert-butyl-dimethylsilane
CID 153453215
3-Methyl-1-tripropylsilyloxybut-2-ene
CID 531303
1-Butyldimethylsilyloxy-3-methylbut-2-ene
CID 531325
1-Diisopropylsilyloxy-3-methylbut-2-ene
CID 6327728
[(E)-4-bromo-2-methylbut-2-enoxy]-tert-butyl-dimethylsilane
CID 11161775
[(Z)-3-bromoprop-2-enoxy]-tert-butyl-dimethylsilane
CID 132477920

Frequently Asked Questions

What is the IUPAC name of [(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane?
The IUPAC name of [(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane (CID 11323435) is [(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane.
What is the SMILES notation for [(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane?
The canonical SMILES for [(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane is CC[Si](CC)(CC)OC/C(C)=C/CBr.
What is the InChIKey of [(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane?
The InChIKey is ROASVDVPMZYRSM-DHZHZOJOSA-N. The full InChI is InChI=1S/C11H23BrOSi/c1-5-14(6-2,7-3)13-10-11(4)8-9-12/h8H,5-7,9-10H2,1-4H3/b11-8+.
What are the key properties of [(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane?
[(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane has a molecular weight of 279.29 g/mol, XLogP of 4.35, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-4-bromo-2-methylbut-2-enoxy]-triethylsilane is sourced from PubChem (CID 11323435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).