bromo-tert-butyl-phenylsilane

C10H15BrSi — CID 123583339

IUPACbromo-tert-butyl-phenylsilane
SMILESCC(C)(C)[SiH](Br)c1ccccc1
InChIInChI=1S/C10H15BrSi/c1-10(2,3)12(11)9-7-5-4-6-8-9/h4-8,12H,1-3H3
InChIKeyRDPMEQAPDXSDAN-UHFFFAOYSA-N
MW243.22 g/mol
LogP2.81
Rot. Bonds1

About bromo-tert-butyl-phenylsilane

bromo-tert-butyl-phenylsilane (PubChem CID 123583339) has the molecular formula C10H15BrSi and a molecular weight of 243.22 g/mol. Its IUPAC name is bromo-tert-butyl-phenylsilane.

Molecular Properties

Compound Namebromo-tert-butyl-phenylsilane
PubChem CID123583339
Molecular FormulaC10H15BrSi
Molecular Weight243.22 g/mol
Exact Mass242.01
IUPAC Namebromo-tert-butyl-phenylsilane
SMILESCC(C)(C)[SiH](Br)c1ccccc1
InChIInChI=1S/C10H15BrSi/c1-10(2,3)12(11)9-7-5-4-6-8-9/h4-8,12H,1-3H3
InChIKeyRDPMEQAPDXSDAN-UHFFFAOYSA-N
XLogP2.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.22
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

bromo(diphenyl)silane
CID 102303968
bromo-phenyl-propan-2-ylsilane
CID 123224293
N-diphenylsilyl-2-methylpropan-2-amine
CID 101496715
(3-bromo-4,4-dimethylpent-1-yn-3-yl)-diphenylsilane
CID 173045401
dimethyl(phenyl)silane;hydrochloride
CID 172741806
(1-bromo-1-phenylethyl)benzene
CID 19019197
(3,5-ditert-butylphenyl)-diphenylsilane
CID 150839348
2-chloropropan-2-yl-phenyl-(trifluoromethyl)silane
CID 123252652
tert-butyl-hexa-2,4-dien-3-yl-phenylsilane
CID 123624156
N-ditert-butylsilylaniline
CID 123559460
bromo-methyl-bis(2-phenylpropan-2-yl)silane
CID 155648122
ethyl-[ethyl(phenyl)silyl]-phenylsilane
CID 123339883

Frequently Asked Questions

What is the IUPAC name of bromo-tert-butyl-phenylsilane?
The IUPAC name of bromo-tert-butyl-phenylsilane (CID 123583339) is bromo-tert-butyl-phenylsilane.
What is the SMILES notation for bromo-tert-butyl-phenylsilane?
The canonical SMILES for bromo-tert-butyl-phenylsilane is CC(C)(C)[SiH](Br)c1ccccc1.
What is the InChIKey of bromo-tert-butyl-phenylsilane?
The InChIKey is RDPMEQAPDXSDAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrSi/c1-10(2,3)12(11)9-7-5-4-6-8-9/h4-8,12H,1-3H3.
What are the key properties of bromo-tert-butyl-phenylsilane?
bromo-tert-butyl-phenylsilane has a molecular weight of 243.22 g/mol, XLogP of 2.81, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromo-tert-butyl-phenylsilane is sourced from PubChem (CID 123583339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).