Benzoic acid, 2,5-dichloro-, ethyl ester


Chemical Name: Benzoic acid, 2,5-dichloro-, ethyl ester
CAS Number: 35112-27-7
Product Number: AG003Q2I(AGN-PC-0JLOG7)
Synonyms:
MDL No:
Molecular Formula: C9H8Cl2O2
Molecular Weight: 219.0646

Identification/Properties


Properties
BP:
270-271°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
1.5360
Computed Properties
Molecular Weight:
219.061g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
217.99g/mol
Monoisotopic Mass:
217.99g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
185
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback


Chemical Structure



Ethyl 2,5-dichlorobenzoate, a key compound in chemical synthesis, is a versatile building block used in various organic reactions to introduce a dichlorobenzoate group into target molecules. This ester compound is particularly significant in the preparation of pharmaceuticals, agrochemicals, and advanced materials due to its unique chemical reactivity. In organic synthesis, Ethyl 2,5-dichlorobenzoate can serve as a precursor for the synthesis of complex molecules by undergoing reactions such as nucleophilic substitution, esterification, and radical reactions. Its ability to selectively react with different functional groups makes it a valuable tool for chemists in designing efficient synthetic routes for the production of diverse compounds. Additionally, the presence of dichlorobenzoate moiety in the molecule can impart specific properties and functionalities to the final products, expanding the scope of applications in various industries.