3,6-Dichloroanthranilic acid

C₇H₅Cl₂NO₂CAS 3032-32-4206.02 g/mol

Open in Covalent MOL file

Aryl halide Carboxylic acid Primary amine

Properties

Molecular formula: C₇H₅Cl₂NO₂
Molar mass: 206.02 g/mol
Exact mass: 204.9697 Da
logP: 2.27Crippen estimate
Polar surface area: 63.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Identifiers

CAS number

3032-32-4

SMILES

C1=CC(=C(C(=C1Cl)C(=O)O)N)Cl

InChIKey

MMIREQFMYZQWLU-UHFFFAOYSA-N

InChI

InChI=1S/C7H5Cl2NO2/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2H,10H2,(H,11,12)

Weigh it out

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

Names and synonyms

1 names

2-Amino-3,6-dichlorobenzoic acid

Work with 3,6-Dichloroanthranilic acid

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

2,6-Dichlorobenzoic acid50-30-662 % similar 2,3,6-Trichlorobenzoic acid50-31-761 % similar 2-Amino-6-chlorobenzoic acid2148-56-361 % similar 2-Amino-3-chlorobenzoic acid6388-47-261 % similar 3,6-Dichlorosalicylic acid3401-80-759 % similar 2-Chloro-6-hydroxybenzoic acid56961-31-053 % similar 2,6-Dichloro-3-fluorobenzoic acid178813-78-053 % similar Dicamba1918-00-953 % similar

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

Same formula

2-Chloro-6-methoxyisonicotinoyl chloride116853-97-5 Chloramben133-90-4 2-Amino-4,5-dichlorobenzoic acid20776-61-8 4,6-Dichloroanthranilic acid20776-63-0 3,5-Dichloroanthranilic acid2789-92-6 1,3-Dichloro-2-methyl-4-nitrobenzene29682-46-0 Methyl 2,6-dichloroisonicotinate42521-09-5 4-Amino-3,5-dichlorobenzoic acid56961-25-2

Elsewhere

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