2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane

C16H27BrOSi — CID 14257862

IUPAC2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane
SMILESCC(C)C(C)(C)[Si](C)(C)OCCc1ccc(Br)cc1
InChIInChI=1S/C16H27BrOSi/c1-13(2)16(3,4)19(5,6)18-12-11-14-7-9-15(17)10-8-14/h7-10,13H,11-12H2,1-6H3
InChIKeyXLVKZCYMUMEOHG-UHFFFAOYSA-N
MW343.38 g/mol
LogP5.65
Rot. Bonds6

About 2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane

2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane (PubChem CID 14257862) has the molecular formula C16H27BrOSi and a molecular weight of 343.38 g/mol. Its IUPAC name is 2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane.

Molecular Properties

Compound Name2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane
PubChem CID14257862
Molecular FormulaC16H27BrOSi
Molecular Weight343.38 g/mol
Exact Mass342.10
IUPAC Name2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane
SMILESCC(C)C(C)(C)[Si](C)(C)OCCc1ccc(Br)cc1
InChIInChI=1S/C16H27BrOSi/c1-13(2)16(3,4)19(5,6)18-12-11-14-7-9-15(17)10-8-14/h7-10,13H,11-12H2,1-6H3
InChIKeyXLVKZCYMUMEOHG-UHFFFAOYSA-N
XLogP5.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.38
LogP ≤ 55.65
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

2-[4-(3-bromopropyl)phenyl]ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane
CID 14257863
1-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]phenyl]ethanol
CID 70662083
2,3-dimethylbutan-2-yl-dimethyl-[2-[4-[3-(3-phenylthiolan-3-yl)propyl]phenyl]ethoxy]silane
CID 22155504
(4-bromophenyl)methoxy-tert-butyl-dimethylsilane
CID 10859583
tert-butyl-dimethyl-(2-phenylethoxy)silane
CID 11128311
2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane
CID 11515183
O-[2-(4-bromophenyl)ethyl]hydroxylamine
CID 83486185
1-bromo-4-[2-(3-methylbutoxy)ethyl]benzene
CID 91691607
[4-[2-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxyethyl]phenyl]-[2-[(4-ethoxyphenyl)diazenyl]-1,3-benzothiazol-5-yl]diazene
CID 170542708
[2-bromo-4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]phenoxy]-tert-butyl-dimethylsilane
CID 102589109
tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane
CID 58097772
tert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane
CID 100946322

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane?
The IUPAC name of 2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane (CID 14257862) is 2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane.
What is the SMILES notation for 2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane?
The canonical SMILES for 2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane is CC(C)C(C)(C)[Si](C)(C)OCCc1ccc(Br)cc1.
What is the InChIKey of 2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane?
The InChIKey is XLVKZCYMUMEOHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27BrOSi/c1-13(2)16(3,4)19(5,6)18-12-11-14-7-9-15(17)10-8-14/h7-10,13H,11-12H2,1-6H3.
What are the key properties of 2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane?
2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane has a molecular weight of 343.38 g/mol, XLogP of 5.65, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)ethoxy-(2,3-dimethylbutan-2-yl)-dimethylsilane is sourced from PubChem (CID 14257862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).