2-Bromobenzaldehyde diethyl acetal

C₁₁H₁₅BrO₂CAS 35822-58-3259.14 g/mol

Open in Covalent MOL file

Acetal Aryl halide Ether

Properties

Molecular formula: C₁₁H₁₅BrO₂
Molar mass: 259.14 g/mol
Exact mass: 258.0255 Da
logP: 3.52Crippen estimate
Polar surface area: 18.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 5

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

35822-58-3

SMILES

CCOC(C1=CC=CC=C1Br)OCC

InChIKey

APDGYQVYBWGBSD-UHFFFAOYSA-N

InChI

InChI=1S/C11H15BrO2/c1-3-13-11(14-4-2)9-7-5-6-8-10(9)12/h5-8,11H,3-4H2,1-2H3

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Names and synonyms

1 names

1-Bromo-2-(diethoxymethyl)benzene

Work with 2-Bromobenzaldehyde diethyl acetal

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-(2-Bromophenyl)-1,3-dioxolane34824-58-368 % similar (Diethoxymethyl)benzene774-48-153 % similar 1-Bromo-2-(1-methylethyl)benzene7073-94-147 % similar 2-Furfural diethyl acetal13529-27-644 % similar Ethyl 2-bromobenzoate6091-64-143 % similar 1-(2-Bromophenyl)ethan-1-ol114446-55-842 % similar (R)-1-(2-Bromophenyl)ethanol76116-20-642 % similar (Benzylamino)acetaldehyde diethyl acetal61190-10-139 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-Bromo-1-adamantanecarboxylic acid21816-08-0 1-Bromo-4-(diethoxymethyl)benzene34421-94-8 3-Bromobenzaldehyde diethyl acetal75148-49-1

Elsewhere

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