2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane

C14H23BrOSi — CID 11515183

IUPAC2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCc1cccc(Br)c1
InChIInChI=1S/C14H23BrOSi/c1-14(2,3)17(4,5)16-10-9-12-7-6-8-13(15)11-12/h6-8,11H,9-10H2,1-5H3
InChIKeyHRFLXGYDQUBZCO-UHFFFAOYSA-N
MW315.33 g/mol
LogP5.01
Rot. Bonds4

About 2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane

2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane (PubChem CID 11515183) has the molecular formula C14H23BrOSi and a molecular weight of 315.33 g/mol. Its IUPAC name is 2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane
PubChem CID11515183
Molecular FormulaC14H23BrOSi
Molecular Weight315.33 g/mol
Exact Mass314.07
IUPAC Name2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCc1cccc(Br)c1
InChIInChI=1S/C14H23BrOSi/c1-14(2,3)17(4,5)16-10-9-12-7-6-8-13(15)11-12/h6-8,11H,9-10H2,1-5H3
InChIKeyHRFLXGYDQUBZCO-UHFFFAOYSA-N
XLogP5.01
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500315.33
LogP ≤ 55.01
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

tert-butyl-dimethyl-(2-phenylethoxy)silane
CID 11128311
[2-bromo-4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]phenoxy]-tert-butyl-dimethylsilane
CID 102589109
4-(3-bromophenyl)butoxy-tert-butyl-diphenylsilane
CID 69439190
2-(5-bromo-2-iodophenyl)ethoxy-tert-butyl-dimethylsilane
CID 164858094
ethyl 2-[(3-bromophenyl)methyl]-6-[tert-butyl(dimethyl)silyl]oxy-2-methylhexanoate
CID 10813724
1-bromo-3-(3,3-dimethylbutyl)benzene
CID 58974913
2-[1-[(3-bromophenyl)methyl]-3-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrazol-5-yl]propan-2-ol
CID 140753812
1-bromo-3-[2-(methoxymethoxy)ethyl]benzene
CID 22314975
tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane
CID 58097772
3-[3-[5-[tert-butyl(dimethyl)silyl]oxypentoxy]phenyl]propan-1-amine
CID 67316685
1-[(3-bromophenyl)methyl]-5-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrazole-3-carbaldehyde
CID 140753775
[5-(3-bromophenyl)furan-2-yl]methoxy-tert-butyl-dimethylsilane
CID 19006181

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane?
The IUPAC name of 2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane (CID 11515183) is 2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane.
What is the SMILES notation for 2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane?
The canonical SMILES for 2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane is CC(C)(C)[Si](C)(C)OCCc1cccc(Br)c1.
What is the InChIKey of 2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane?
The InChIKey is HRFLXGYDQUBZCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23BrOSi/c1-14(2,3)17(4,5)16-10-9-12-7-6-8-13(15)11-12/h6-8,11H,9-10H2,1-5H3.
What are the key properties of 2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane?
2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane has a molecular weight of 315.33 g/mol, XLogP of 5.01, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 11515183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).