7-Bromo-3,4-dihydro-2H-1,4-benzoxazine

C₈H₈BrNOCAS 105679-22-9214.06 g/mol

Open in Covalent MOL file

Aryl halide Ether Secondary amine

Properties

Molecular formula: C₈H₈BrNO
Molar mass: 214.06 g/mol
Exact mass: 212.9789 Da
logP: 2.25Crippen estimate
Polar surface area: 21.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Identifiers

CAS number

105679-22-9

SMILES

C1COC2=C(N1)C=CC(=C2)Br

InChIKey

JLZUUGCTPRPFKZ-UHFFFAOYSA-N

InChI

InChI=1S/C8H8BrNO/c9-6-1-2-7-8(5-6)11-4-3-10-7/h1-2,5,10H,3-4H2

Weigh it out

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

Names and synonyms

1 names

7-Bromo-3,4-dihydro-2H-benzo[1,4]oxazine

Work with 7-Bromo-3,4-dihydro-2H-1,4-benzoxazine

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

6-Bromo-1,4-benzodioxane52287-51-153 % similar 6-Hydroxybenzomorpholine26021-57-851 % similar 5-Bromo-1,3-benzodioxole2635-13-447 % similar 7-Bromo-1,2,3,4-tetrahydroquinoline114744-51-346 % similar 4-Bromo-1-methoxy-2-(3-methoxypropoxy)benzene173336-76-039 % similar Hc yellow 459820-43-838 % similar Bromoveratrole2859-78-138 % similar 6-Bromo-1,4-dihydro-2H-3,1-benzoxazin-2-one1017783-09-336 % similar

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

Same formula

Bromoacetanilide103-88-8 6-Bromo-3,4-dihydro-2H-benzo[1,4]oxazine105655-01-4 4-Bromo-3-methylbenzamide170229-98-8 N-(2-Bromophenyl)acetamide614-76-6

Elsewhere

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