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635-21-2

635-21-2 Structure

635-21-2 Structure
IdentificationMore
[Name]

2-Amino-5-chlorobenzoic acid
[CAS]

635-21-2
[Synonyms]

2-AMINO-5-CHLOROBENZOIC ACID
2-CARBOXY-4-CHLOROANILINE
5-AMINO-3-CARBOXY-1-CHLOROBENZENE
5-CHLORO-2-AMINOBENZOIC ACID
5-CHLOROANTHRANILIC ACID
OTAVA-BB BB7020040772
RARECHEM AL BO 0288
2-amino-5-chloro-benzoicaci
Anthranilic acid, 5-chloro-
2-AMINO-5-CHLOROBENZOIC ACID, TECH., 90%
Benzoic acid, 2-amino-5-chloro-
5-CHLORO-2-AMINEBENOATIC ACID
2-AMINO-5-CHLOROBENZOIC ACID (5-CHLOROANTHRANILIC ACID)
[EINECS(EC#)]

211-230-8
[Molecular Formula]

C7H6ClNO2
[MDL Number]

MFCD00007838
[Molecular Weight]

171.58
[MOL File]

635-21-2.mol
Chemical PropertiesBack Directory
[Appearance]

White to light yellow crystal powder
[Melting point ]

204-206 °C (dec.) (lit.)
[Boiling point ]

250°C (rough estimate)
[density ]

1.3246 (rough estimate)
[refractive index ]

1.5560 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

4.57±0.10(Predicted)
[color ]

White to Pale Grey
[Water Solubility ]

Soluble in water.
[BRN ]

639027
[InChIKey]

IFXKXCLVKQVVDI-UHFFFAOYSA-N
[CAS DataBase Reference]

635-21-2(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzoic acid, 2-amino-5-chloro-(635-21-2)
[EPA Substance Registry System]

Benzoic acid, 2-amino-5-chloro- (635-21-2)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R37/38:Irritating to respiratory system and skin .
R36:Irritating to the eyes.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[TSCA ]

Yes
[HS Code ]

29224900
Raw materials And Preparation ProductsBack Directory
[Raw materials]

1-(4-Chlorophenyl)-2-phenyldiazene-->2-Azido-5-chlorobenzoic acid-->4-Chloro-2-methylacetanilide-->2-Bromo-5-chlorobenzoic acid-->Anthranilic acid-->5-Chloroindole-->Methyl 5-chloroanthranilate-->5-Chloroisatin-->3,5-Dichloroanthranilic acid-->5-Chloro-2-nitrobenzoic acid
[Preparation Products]

3-Chlorobenzoic acid-->5-Chloro-2-fluorobenzoic acid-->(2-Amino-5-chlorobenzoyl)hydrazide-->Ethanone,1-(2-amino-5-chlorophenyl)--->2-Amino-5-chlorobenzaldehyde-->2-amino-N-butyl-5-chlorobenzamide
Hazard InformationBack Directory
[Chemical Properties]

White to light yellow crystal powder
[Uses]

2-Amino-5-chlorobenzoic acid is a chlorinated derivative of antharilic acid,it is a metabolite of the pesticide Chlordimeform and it is used in the preparation of disease-modifying antirheumatic drugs (DMARDs).
[Uses]

5-Chloroanthranilic Acid is a chlorinated derivative of anthranilic acid. 5-Chloroanthranilic Acid is a metabolite of the pesticide Chlordimeform. 5-Chloroanthranilic Acid is used in the preparation o f disease-modifying antirheumatic drugs (DMARDs).
[Definition]

ChEBI:2-amino-5-chlorobenzoic acid is a member of the class of chlorobenzoic acids that is benzoic acid in which the ring hydrogens at positions 2 and 5 are replaced by amino and chloro groups, respectively. It is an aminobenzoic acid, a member of monochlorobenzenes and a chlorobenzoic acid.
[reaction suitability]

reaction type: solution phase peptide synthesis
[Synthesis]

5-Chloro-2-nitrobenzoic acid

2516-95-2

2-Amino-5-chlorobenzoic acid

635-21-2

General procedure for the synthesis of 2-amino-5-chlorobenzoic acid from 5-chloro-2-nitrobenzoic acid: active Raney nickel (2 g) was added to the reaction flask, followed by the addition of an ethanol solution of 5-chloro-2-nitrobenzoic acid (20 g, 110 mmol). The reaction mixture was stirred at room temperature in a hydrogen atmosphere overnight. Upon completion of the reaction, the reaction solution was filtered through diatomaceous earth and the filtrate was concentrated under reduced pressure to give 16 g of white solid product (96% yield). The product was characterized by 1H NMR (DMSO-d6): δ 6.77 (d, J = 8.9 Hz, 1H), 7.24 (dd, J = 2.9, 8.9 Hz, 1H), 7.62 (d, J = 2.9 Hz, 1H), 8.7 (br, 3H); EIMS: 170 (M-H).

[References]

[1] Collection of Czechoslovak Chemical Communications, 1984, vol. 49, # 1, p. 86 - 109
[2] Patent: WO2004/74218, 2004, A2. Location in patent: Page 115-116
[3] Bioorganic and Medicinal Chemistry, 1999, vol. 7, # 12, p. 2801 - 2809
[4] Chemical Biology and Drug Design, 2016, p. 710 - 723
[5] Zhurnal Obshchei Khimii, 1938, vol. 8, p. 1797,1801
Spectrum DetailBack Directory
[Spectrum Detail]

2-Amino-5-chlorobenzoic acid(635-21-2)MS
2-Amino-5-chlorobenzoic acid(635-21-2)1HNMR
2-Amino-5-chlorobenzoic acid(635-21-2)IR1
2-Amino-5-chlorobenzoic acid(635-21-2)IR2
2-Amino-5-chlorobenzoic acid(635-21-2)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-Amino-5-chlorobenzoic acid, 98%(635-21-2)
[Alfa Aesar]

2-Amino-5-chlorobenzoic acid, 98%(635-21-2)
[Sigma Aldrich]

635-21-2(sigmaaldrich)
[TCI AMERICA]

5-Chloroanthranilic Acid,>99.0%(T)(635-21-2)
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