4-Bromo-2,6-dimethylanisole

C₉H₁₁BrOCAS 14804-38-7215.09 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₉H₁₁BrO
Molar mass: 215.09 g/mol
Exact mass: 213.9993 Da
logP: 3.07Crippen estimate
Polar surface area: 9.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Identifiers

CAS number

14804-38-7

SMILES

CC1=CC(=CC(=C1OC)C)Br

InChIKey

MMARFGDTMJBIBK-UHFFFAOYSA-N

InChI

InChI=1S/C9H11BrO/c1-6-4-8(10)5-7(2)9(6)11-3/h4-5H,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 4-Bromo-2,6-dimethylanisole

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

1-Bromo-3,4,5-trimethoxybenzene2675-79-858 % similar 2,4,6-Tribromoanisole607-99-858 % similar 4-Bromo-2-methylanisole14804-31-055 % similar 4-Bromo-2,6-difluoroanisole104197-14-054 % similar 2,6-Dimethylanisole1004-66-650 % similar 5-Bromo-2-iodo-1,3-dimethylbenzene206559-43-550 % similar 1,3-Dibromo-5-methoxybenzene74137-36-350 % similar 4-Bromo-2,6-dimethylphenol2374-05-248 % similar

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

Same formula

1-Bromo-3-isopropoxybenzene131738-73-3 Benzyl 2-bromoethyl ether1462-37-9 (3-Bromopropoxy)benzene588-63-6 1-Bromo-2-(1-methylethoxy)benzene701-07-5

Elsewhere

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