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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)-

2-Nitro-benzoic acid ethyl ester

CCOC(=O)c1ccccc1[N+](=O)[O-] Request for Quotation
Chemical Name: 2-Nitro-benzoic acid ethyl ester
CAS Number: 610-34-4
Product Number: AG003Q50(AGN-PC-0WAJLU)
Synonyms:
MDL No:
Molecular Formula: C9H9NO4
Molecular Weight: 195.1721

Identification/Properties

Properties
MP:
26-30℃
BP:
275°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Computed Properties
Molecular Weight:
195.174g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
195.053g/mol
Monoisotopic Mass:
195.053g/mol
Topological Polar Surface Area:
72.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
223
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

NMR Spectrum

Other Analytical Data

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Chemical Structure


Ethyl 2-nitrobenzoate is a versatile compound widely used in chemical synthesis for its unique characteristics and diverse applications. In organic chemistry, it serves as a key intermediate in the synthesis of various pharmaceuticals, agrochemicals, and dyes. Its nitro group can undergo reduction reactions to yield valuable amino derivatives, while its ester functionality can participate in acylation reactions, enabling the introduction of new functional groups. Additionally, Ethyl 2-nitrobenzoate can be employed in the preparation of complex molecules and natural products through various transformations such as nucleophilic substitution and palladium-catalyzed cross-coupling reactions. Its stability and reactivity make it an essential building block in the creation of novel compounds for research and industrial applications.