2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane

C15H25BrOSi — CID 174100478

IUPAC2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane
SMILESCC(CO[Si](C)(C)C(C)(C)C)c1ccccc1Br
InChIInChI=1S/C15H25BrOSi/c1-12(13-9-7-8-10-14(13)16)11-17-18(5,6)15(2,3)4/h7-10,12H,11H2,1-6H3
InChIKeyDZKLYMVOJFKDAM-UHFFFAOYSA-N
MW329.35 g/mol
LogP5.57
Rot. Bonds4

About 2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane

2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane (PubChem CID 174100478) has the molecular formula C15H25BrOSi and a molecular weight of 329.35 g/mol. Its IUPAC name is 2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane
PubChem CID174100478
Molecular FormulaC15H25BrOSi
Molecular Weight329.35 g/mol
Exact Mass328.09
IUPAC Name2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane
SMILESCC(CO[Si](C)(C)C(C)(C)C)c1ccccc1Br
InChIInChI=1S/C15H25BrOSi/c1-12(13-9-7-8-10-14(13)16)11-17-18(5,6)15(2,3)4/h7-10,12H,11H2,1-6H3
InChIKeyDZKLYMVOJFKDAM-UHFFFAOYSA-N
XLogP5.57
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.35
LogP ≤ 55.57
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

4-(2-bromophenyl)-2-methylpentan-2-amine
CID 83913148
tert-butyl-dimethyl-[(2S)-2-methyl-3-phenoxypropoxy]silane
CID 141099859
tert-butyl-[(2R,3S)-2,3-dimethyl-4,4-bis(phenylselanyl)butoxy]-dimethylsilane
CID 10720890
2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethanamine
CID 11459395
tert-butyl-[(2R,3S)-3-deuterio-2-methyl-3-phenylpropoxy]-dimethylsilane
CID 177106743
tert-butyl-[(E)-2,3-dibromo-5-phenylpent-4-enoxy]-dimethylsilane
CID 169094383
[(3S)-4-[tert-butyl(dimethyl)silyl]oxy-3-methylbutyl]-triphenylphosphanium
CID 11410748
(2-bromophenyl)-[4-[tert-butyl(dimethyl)silyl]oxy-3,5-dimethylphenyl]methanol
CID 102380475
tert-butyl-[(2R,3R)-2,3-dichloro-5-phenylpentoxy]-dimethylsilane
CID 86287443
[2-bromo-3-[tert-butyl(dimethyl)silyl]oxypropoxy]-tert-butyl-dimethylsilane
CID 125380572
tert-butyl-[2-(4-chloro-2-fluorophenyl)-2-(2,6-dibromophenoxy)ethoxy]-dimethylsilane
CID 167433936
4-[tert-butyl(dimethyl)silyl]oxy-N-[1-[tert-butyl(dimethyl)silyl]oxypropan-2-yl]-N-phenylaniline
CID 163216748

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane?
The IUPAC name of 2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane (CID 174100478) is 2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane.
What is the SMILES notation for 2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane?
The canonical SMILES for 2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane is CC(CO[Si](C)(C)C(C)(C)C)c1ccccc1Br.
What is the InChIKey of 2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane?
The InChIKey is DZKLYMVOJFKDAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25BrOSi/c1-12(13-9-7-8-10-14(13)16)11-17-18(5,6)15(2,3)4/h7-10,12H,11H2,1-6H3.
What are the key properties of 2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane?
2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane has a molecular weight of 329.35 g/mol, XLogP of 5.57, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)propoxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 174100478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).