CAS 63105-54-4

Methyl 2,3-dichloro-5-nitrobenzoate

Description:

Methyl 2,3-dichloro-5-nitrobenzoate, with the CAS number 63105-54-4, is an organic compound that belongs to the class of benzoates. It features a benzoate structure with a methyl ester functional group, which contributes to its solubility in organic solvents. The presence of two chlorine atoms and a nitro group on the aromatic ring significantly influences its chemical reactivity and physical properties. Typically, compounds like this exhibit moderate to high stability under standard conditions but may undergo reactions such as nucleophilic substitution or reduction due to the electron-withdrawing nature of the nitro and chloro substituents. This compound may be used in various applications, including as an intermediate in organic synthesis or in the development of agrochemicals. Safety data should be consulted for handling, as halogenated compounds can pose environmental and health risks. Overall, Methyl 2,3-dichloro-5-nitrobenzoate is characterized by its unique functional groups, which dictate its reactivity and potential applications in chemical synthesis.

Formula: C₈H₅Cl₂NO₄

InChI: InChI=1S/C8H5Cl2NO4/c1-15-8(12)5-2-4(11(13)14)3-6(9)7(5)10/h2-3H,1H3

InChI key: InChIKey=IIOLRSLJSWKIEX-UHFFFAOYSA-N

SMILES: C(OC)(=O)C1=CC(N(=O)=O)=CC(Cl)=C1Cl

Synonyms:

• Benzoic acid, 2,3-dichloro-5-nitro-, methyl ester
• Methyl 2,3-dichloro-5-nitrobenzoate
• Methyl 2,3-dichloro-5-nitrobenzoate

Methyl 2,3-dichloro-5-nitrobenzoate

CAS: 63105-54-4

Versatile small molecule scaffold

Formula: C₈H₅Cl₂NO₄

Purity: Min. 95%

Molecular weight: 250.03 g/mol

Ref: 3D-NCA10554