2-Amino-5-chlorobenzonitrile

2-Amino-5-chlorobenzonitrile Basic information
Product Name:2-Amino-5-chlorobenzonitrile
Synonyms:5-CHLOROANTHRANILONITRILE;AMINO(2-) 5-CHLORO-BENZONITRILE;2-amino-5-chloro-benzonitril;2-AMINO-5-CHLOROBENZONITRILE;TIMTEC-BB SBB004050;1-CYANO-2-AMINO-5-CHLOROBENZENE;4-Chloro-2-cyanoaniline;2-AMINO-5-CHLORBENZOESAEURENITRIL 98+%
CAS:5922-60-1
MF:C7H5ClN2
MW:152.58
EINECS:227-651-5
Product Categories:FINE Chemical & INTERMEDIATES;Anilines, Aromatic Amines and Nitro Compounds;pharmacetical;Nitriles
Mol File:5922-60-1.mol
2-Amino-5-chlorobenzonitrile Structure
2-Amino-5-chlorobenzonitrile Chemical Properties
Melting point 96-99 °C (lit.)
Boiling point 132-135 °C/0.5 mmHg (lit.)
density 1.2763 (rough estimate)
refractive index 1.5500 (estimate)
Fp >230 °F
storage temp. Keep in dark place,Inert atmosphere,Room temperature
solubility Chloroform (Slightly), DMSO (Slightly)
pka1.18±0.10(Predicted)
form Crystalline Needles
color White to light beige
CAS DataBase Reference5922-60-1(CAS DataBase Reference)
EPA Substance Registry SystemBenzonitrile, 2-amino-5-chloro- (5922-60-1)
Safety Information
Hazard Codes Xn,Xi
Risk Statements 20/21/22-36/37/38
Safety Statements 26-36-36/37/39
RIDADR 3276
WGK Germany 3
Hazard Note Irritant
TSCA Yes
HazardClass 6.1
PackingGroup III
HS Code 29269090
MSDS Information
ProviderLanguage
5-Chloroanthranilonitrile English
SigmaAldrich English
ACROS English
ALFA English
2-Amino-5-chlorobenzonitrile Usage And Synthesis
Chemical Propertieswhite to light beige crystalline needles
Uses2-Amino-5-chlorobenzonitrile was used to build up the 2,2-dioxide-1H-2,1,3-benzothiadiazine ring system.
PreparationSynthesis of 2-amino-5-chlorobenzonitrile is reported in the literature by two methods. The first method involves synthesis from 2-aminobenzonitrile, N-chlorosuccinimide an d acetonitrile. The second method involves synthesis from 5-chloroisatin-β-oxime and bis(2-ethylhexyl)phthalate. Both the methods are not feasible commercially as far as the cost and availability of raw materials are concerned.
Synthesis Reference(s)Synthetic Communications, 20, p. 71, 1990 DOI: 10.1080/00397919008054617
General DescriptionThe vibrational spectra of 2-amino-5-chlorobenzonitrile was studied using density functinal theory.
5-CHLORO-2-ISOCYANATOBENZONITRILE 5-CHLORO-2-(1H-1,2,4-TRIAZOL-1-YL)BENZONITRILE ACETAMINOPHENOL BP/USP N-(3,4-DICHLORO-2-CYANOPHENYL)FORMAMIDE 5-AMINO-2-CHLOROBENZONITRILE 5-CHLORO-2-METHYLAMINOBENZONITRILE EC 2.6.1.2 6-AMINO-2,3-DICHLOROBENZONITRILE ALTRENOGEST 2,4-DICHLORO-6-CYANOPHENYLISOTHIOCYANATE 2-Amino-3,5-dichlorobenzonitrile (4-CHLORO-2-CYANO-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER 2-AMINO-3-BROMO-5-CHLOROBENZONITRILE 2-Amino-5-chloro-4-nitrobenzonitrile 4-Chloro-2-cyanophenylisothiocyanate 5-Chloro-2-nitrobenzonitrile AMINO ACIDS 2,3-Dichloro-6-nitrobenzonitrile

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