bromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane

C10H13BrClFOSi — CID 91735266

IUPACbromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane
SMILESC[Si](C)(CBr)OCc1c(F)cccc1Cl
InChIInChI=1S/C10H13BrClFOSi/c1-15(2,7-11)14-6-8-9(12)4-3-5-10(8)13/h3-5H,6-7H2,1-2H3
InChIKeyYJQOOCZVGMFBJD-UHFFFAOYSA-N
MW311.65 g/mol
LogP4.13
Rot. Bonds4

About bromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane

bromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane (PubChem CID 91735266) has the molecular formula C10H13BrClFOSi and a molecular weight of 311.65 g/mol. Its IUPAC name is bromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane.

Molecular Properties

Compound Namebromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane
PubChem CID91735266
Molecular FormulaC10H13BrClFOSi
Molecular Weight311.65 g/mol
Exact Mass309.96
IUPAC Namebromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane
SMILESC[Si](C)(CBr)OCc1c(F)cccc1Cl
InChIInChI=1S/C10H13BrClFOSi/c1-15(2,7-11)14-6-8-9(12)4-3-5-10(8)13/h3-5H,6-7H2,1-2H3
InChIKeyYJQOOCZVGMFBJD-UHFFFAOYSA-N
XLogP4.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.65
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane?
The IUPAC name of bromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane (CID 91735266) is bromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane.
What is the SMILES notation for bromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane?
The canonical SMILES for bromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane is C[Si](C)(CBr)OCc1c(F)cccc1Cl.
What is the InChIKey of bromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane?
The InChIKey is YJQOOCZVGMFBJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrClFOSi/c1-15(2,7-11)14-6-8-9(12)4-3-5-10(8)13/h3-5H,6-7H2,1-2H3.
What are the key properties of bromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane?
bromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane has a molecular weight of 311.65 g/mol, XLogP of 4.13, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bromomethyl-[(2-chloro-6-fluorophenyl)methoxy]-dimethylsilane is sourced from PubChem (CID 91735266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).