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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)-

Benzoic acid, 2-chloro-4-nitro-, methyl ester

COC(=O)c1ccc(cc1Cl)[N+](=O)[O-] Request for Quotation
Chemical Name: Benzoic acid, 2-chloro-4-nitro-, methyl ester
CAS Number: 13324-11-3
Product Number: AG0014GC(AGN-PC-0JLUGX)
Synonyms:
MDL No:
Molecular Formula: C8H6ClNO4
Molecular Weight: 215.5905

Identification/Properties

Properties
MP:
77-78 °C
BP:
324.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
215.589g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
214.999g/mol
Monoisotopic Mass:
214.999g/mol
Topological Polar Surface Area:
72.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
240
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#:
N/A
Hazard Statements:
H315-H319
Precautionary Statements:
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


Methyl 2-chloro-4-nitrobenzoate plays a crucial role in chemical synthesis as a versatile building block for creating various organic compounds. Its unique structure provides a platform for the introduction of functional groups through various chemical reactions, making it an essential reagent in the production of pharmaceuticals, agrochemicals, and fine chemicals. This compound is particularly valued for its ability to undergo nucleophilic substitution reactions, allowing for the efficient modification and functionalization of organic molecules. With its diverse applications in synthetic chemistry, Methyl 2-chloro-4-nitrobenzoate serves as a valuable tool for researchers and chemists seeking to design and produce novel compounds with specific properties and functions.