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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

1,3-Benzenedicarboxylic acid, 5-chloro-

Clc1cc(cc(c1)C(=O)O)C(=O)O Request for Quotation
Chemical Name: 1,3-Benzenedicarboxylic acid, 5-chloro-
CAS Number: 2157-39-3
Product Number: AG00BNX7(AGN-PC-0JLP4K)
Synonyms:
MDL No:
Molecular Formula: C8H5ClO4
Molecular Weight: 200.5759

Identification/Properties

Properties
MP:
279-280℃
BP:
424.5°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
200.574g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
199.988g/mol
Monoisotopic Mass:
199.988g/mol
Topological Polar Surface Area:
74.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
206
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:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


5-Chloroisophthalic Acid is a key intermediate in chemical synthesis with versatile applications. This compound serves as a crucial building block in the production of various specialty chemicals, including pharmaceuticals, dyes, and polymers. Its ability to undergo selective reactions makes it a valuable tool in organic chemistry processes.One of the primary uses of 5-Chloroisophthalic Acid is in the synthesis of pharmaceutical compounds. It can be utilized to create different drug molecules by introducing specific functional groups and structural modifications. The presence of a chlorine atom in its molecular structure provides opportunities for creating new drug candidates with improved bioavailability and efficacy.In addition to pharmaceuticals, this compound is also important in the development of dyes and pigments. Its unique chemical properties make it an excellent precursor for producing vibrant and stable colorants used in various industries. By modifying the structure of 5-Chloroisophthalic Acid, chemists can tailor the properties of the resulting dyes to meet specific application requirements.Furthermore, 5-Chloroisophthalic Acid plays a significant role in polymer chemistry. It can be polymerized to form high-performance materials with desirable characteristics such as thermal stability, chemical resistance, and mechanical strength. Polymers derived from this compound find applications in coatings, adhesives, and engineering plastics, among other industrial sectors.Overall, the versatility of 5-Chloroisophthalic Acid in chemical synthesis allows for the creation of a wide range of valuable products essential for various industrial applications. Whether in pharmaceuticals, dyes, or polymers, this compound serves as a foundational component in the development of innovative and functional materials.