2-Amino-6-bromo-3-formylchromone

C₁₀H₆BrNO₃CAS 73262-04-1268.07 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Primary amine

Properties

Molecular formula: C₁₀H₆BrNO₃
Molar mass: 268.07 g/mol
Exact mass: 266.9531 Da
logP: 1.95Crippen estimate
Polar surface area: 73.3 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 1

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 38 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

73262-04-1

SMILES

C1=CC2=C(C=C1Br)C(=O)C(=C(O2)N)C=O

InChIKey

AUIUQJYBTPKQGS-UHFFFAOYSA-N

InChI

InChI=1S/C10H6BrNO3/c11-5-1-2-8-6(3-5)9(14)7(4-13)10(12)15-8/h1-4H,12H2

Weigh it out

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

Work with 2-Amino-6-bromo-3-formylchromone

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-Amino-6-chloro-3-formylchromone68301-77-967 % similar 2-Amino-3-formylchromone61424-76-863 % similar 6-Bromo-3-formylchromone52817-12-653 % similar 2,8-Dibromodibenzofuran10016-52-145 % similar 6-Bromo-4-hydroxycoumarin4139-61-140 % similar 6-Bromochromone-3-carbonitrile52817-13-740 % similar 2-Bromodibenzofuran86-76-040 % similar 2-Amino-5-bromobenzaldehyde29124-57-039 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

6-Bromo-4-hydroxyquinoline-3-carboxylic acid98948-95-9

Elsewhere

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