6-Bromo-2(3H)-benzoxazolone

C₇H₄BrNO₂CAS 19932-85-5214.02 g/mol

Open in Covalent MOL file

Aryl halide Phenol

Properties

Molecular formula: C₇H₄BrNO₂
Molar mass: 214.02 g/mol
Exact mass: 212.9425 Da
Melting point: 188–190 °C
logP: 2.30Crippen estimate
Polar surface area: 46.3 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Identifiers

CAS number

19932-85-5

SMILES

Oc1nc2ccc(Br)cc2o1

InChIKey

DDNKJFBQMQOIKI-UHFFFAOYSA-N

InChI

InChI=1S/C7H4BrNO2/c8-4-1-2-5-6(3-4)11-7(10)9-5/h1-3H,(H,9,10)

Weigh it out

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

Names and synonyms

10 names

2(3H)-Benzoxazolone, 6-bromo-
2-Benzoxazolinone, 6-bromo-
6-Bromo-2-benzoxazolinone
6-Bromo-2-benzoxazolone
6-Bromobenzoxazolone
6-Bromo-3H-benzoxazol-2-one
NSC 26190
Cincreasin
6-Bromo-1,3-benzoxazol-2(3H)-one
6-Bromobenzo[d]oxazol-2(3H)-one

Work with 6-Bromo-2(3H)-benzoxazolone

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-Chloro-2,3-dihydrobenzoxazol-2-one19932-84-459 % similar Coixol532-91-254 % similar 2(3H)-Benzoxazolone59-49-453 % similar 6-Nitro-2-benzoxazolone4694-91-150 % similar Chlorzoxazone95-25-046 % similar 6-Bromo-2-benzothiazolinone62266-82-442 % similar 2,8-Dibromodibenzofuran10016-52-139 % similar 2-(3-Bromophenyl)benzoxazole99586-31-938 % similar

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

Same formula

5-Bromo-2-benzoxazolinone14733-73-4

Elsewhere

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