bromo-methoxy-methyl-phenylsilane

C8H11BrOSi — CID 140744784

IUPACbromo-methoxy-methyl-phenylsilane
SMILESCO[Si](C)(Br)c1ccccc1
InChIInChI=1S/C8H11BrOSi/c1-10-11(2,9)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKeySYEXWGHBROTKMA-UHFFFAOYSA-N
MW231.17 g/mol
LogP2.01
Rot. Bonds2

About bromo-methoxy-methyl-phenylsilane

bromo-methoxy-methyl-phenylsilane (PubChem CID 140744784) has the molecular formula C8H11BrOSi and a molecular weight of 231.17 g/mol. Its IUPAC name is bromo-methoxy-methyl-phenylsilane.

Molecular Properties

Compound Namebromo-methoxy-methyl-phenylsilane
PubChem CID140744784
Molecular FormulaC8H11BrOSi
Molecular Weight231.17 g/mol
Exact Mass229.98
IUPAC Namebromo-methoxy-methyl-phenylsilane
SMILESCO[Si](C)(Br)c1ccccc1
InChIInChI=1S/C8H11BrOSi/c1-10-11(2,9)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKeySYEXWGHBROTKMA-UHFFFAOYSA-N
XLogP2.01
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.17
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bromo-methoxy-methyl-phenylsilane?
The IUPAC name of bromo-methoxy-methyl-phenylsilane (CID 140744784) is bromo-methoxy-methyl-phenylsilane.
What is the SMILES notation for bromo-methoxy-methyl-phenylsilane?
The canonical SMILES for bromo-methoxy-methyl-phenylsilane is CO[Si](C)(Br)c1ccccc1.
What is the InChIKey of bromo-methoxy-methyl-phenylsilane?
The InChIKey is SYEXWGHBROTKMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11BrOSi/c1-10-11(2,9)8-6-4-3-5-7-8/h3-7H,1-2H3.
What are the key properties of bromo-methoxy-methyl-phenylsilane?
bromo-methoxy-methyl-phenylsilane has a molecular weight of 231.17 g/mol, XLogP of 2.01, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bromo-methoxy-methyl-phenylsilane is sourced from PubChem (CID 140744784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).