Name: Name:2-Chloro-4-nitrobenzoic acid
Brand: AABLOCKS
SKU: AA003GUY
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA003GUY

Chemical Name: 2-Chloro-4-nitrobenzoic acid

CAS Number: 99-60-5

Molecular Formula: C7H4ClNO4

Molecular Weight: 201.5640

MDL Number: MFCD00007209

SMILES: OC(=O)c1ccc(cc1Cl)[N+](=O)[O-]

NSC Number: 150

Properties

BP: 362.2 °C at 760 mmHg

Form: Solid

MP: 136-140 °C(lit.)

Refractive Index: 1.6000 (estimate)

Storage: Keep in dry area;Room Temperature;

Complexity: 227

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 13

Hydrogen Bond Acceptor Count: 4

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 1

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 2

Literature fold

Title: 3-Bromo-pyridin-2-amine.

Journal: Acta crystallographica. Section E, Structure reports online20120201

Title: Chemotaxis of Burkholderia sp. strain SJ98 towards chloronitroaromatic compounds that it can metabolise.

Journal: BMC microbiology20120101

Title: Metabolism of 2-chloro-4-nitrophenol in a gram negative bacterium, Burkholderia sp. RKJ 800.

Journal: PloS one20120101

Title: 4-Chloro-2-nitro-benzoic acid-pyrazine (2/1).

Journal: Acta crystallographica. Section E, Structure reports online20111201

Title: 2-Chloro-4-nitro-benzoic acid-quinoline (1/1).

Journal: Acta crystallographica. Section E, Structure reports online20111101

Title: (4-Chloro-3-nitro-benzoato)triphenyl-tin(IV).

Journal: Acta crystallographica. Section E, Structure reports online20110901

Title: (2-Chloro-4-nitro-benzoato)(methanol)triphenyl-tin(IV).

Journal: Acta crystallographica. Section E, Structure reports online20110501

Title: Photoswitching of site-selective RNA scission by sequential incorporation of azobenzene and acridine residues in a DNA oligomer.

Journal: Journal of nucleic acids20110101

Title: Synthesis, characterization, and molecular modeling of a pharmaceutical co-crystal: (2-chloro-4-nitrobenzoic acid):(nicotinamide).

Journal: Journal of pharmaceutical sciences20100901

Title: Tetra-kis(μ-2-chloro-4-nitro-benzoato-κO:O')bis-[aqua-copper(II)].

Journal: Acta crystallographica. Section E, Structure reports online20090101

Title: Two-component molecular crystals composed of chloronitrobenzoic acids and 4-aminopyridine.

Journal: Acta crystallographica. Section C, Crystal structure communications20020401

Title: Morpholinium 2-chloro-4-nitrobenzoate, 2-chloro-5-nitrobenzoate and 4-chloro-3-nitrobenzoate.

Journal: Acta crystallographica. Section C, Crystal structure communications20011201

99-60-5 | 2-Chloro-4-nitrobenzoic acid