2,4-Dichloroquinazoline

C₈H₄Cl₂N₂CAS 607-68-1199.03 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₄Cl₂N₂
Molar mass: 199.03 g/mol
Exact mass: 197.9752 Da
Melting point: 119.5 °C
logP: 2.94Crippen estimate
Polar surface area: 25.8 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Hazards

Warning

H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled20% of notifiers
H302 Harmful if swallowed40% of notifiers
H315 Causes skin irritation80% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 5 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

607-68-1

SMILES

Clc1nc(Cl)c2ccccc2n1

InChIKey

TUQSVSYUEBNNKQ-UHFFFAOYSA-N

InChI

InChI=1S/C8H4Cl2N2/c9-7-5-3-1-2-4-6(5)11-8(10)12-7/h1-4H

Weigh it out

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

Names and synonyms

2 names

Quinazoline, 2,4-dichloro-
NSC 75192

Work with 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

4-Chloro-2-methylquinazoline6484-24-864 % similar 4-Chloro-2-phenylquinazoline6484-25-960 % similar 2,4,6-Trichloroquinazoline20028-68-657 % similar 2-Chloro-4-phenylquinazoline29874-83-757 % similar 2,4-Dichloropyrido[3,4-D]pyrimidine908240-50-657 % similar 2,4-Dichloropyrido[3,2-D]pyrimidine39551-54-753 % similar 6-Bromo-2,4-dichloroquinazoline102393-82-853 % similar 7-Bromo-2,4-dichloroquinazoline959237-68-453 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,6-Dichloroquinoxaline18671-97-1 2,3-Dichloroquinoxaline2213-63-0 5,7-Dichloro-1,6-naphthyridine337958-60-8 1,4-Dichlorophthalazine4752-10-7

Elsewhere

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