7-Bromo-2,4-dichloroquinazoline

C₈H₃BrCl₂N₂CAS 959237-68-4277.93 g/mol

Open in Covalent MOL file

Aryl halide

Properties

Molecular formula: C₈H₃BrCl₂N₂
Molar mass: 277.93 g/mol
Exact mass: 275.8857 Da
logP: 3.70Crippen estimate
Polar surface area: 25.8 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed50% of notifiers
H312 Harmful in contact with skin50% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled50% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

959237-68-4

SMILES

Clc1nc(Cl)c2ccc(Br)cc2n1

InChIKey

RDCSNKDVAPJWGR-UHFFFAOYSA-N

InChI

InChI=1S/C8H3BrCl2N2/c9-4-1-2-5-6(3-4)12-8(11)13-7(5)10/h1-3H

Weigh it out

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

Names and synonyms

1 names

Quinazoline, 7-bromo-2,4-dichloro-

Work with 7-Bromo-2,4-dichloroquinazoline

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

7-Bromo-4-chloroquinazoline573675-55-559 % similar 2,4-Dichloro-7-methoxyquinazoline62484-31-554 % similar 2,4-Dichloroquinazoline607-68-153 % similar 7-Bromo-2-chloroquinazoline953039-66-250 % similar 2,4,6-Trichloroquinazoline20028-68-649 % similar 2,4-Dichloropyrido[3,4-D]pyrimidine908240-50-649 % similar 6-Bromo-1-chloro-isoquinoline205055-63-646 % similar 6-Bromo-4-chloro-quinazoline38267-96-846 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

6-Bromo-2,4-dichloroquinazoline102393-82-8 8-Bromo-2,4-dichloroquinazoline331647-05-3

Elsewhere

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