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CAS Number: 20776-50-5
2-amino-4-bromobenzoic acid

Structure

 2-amino-4-bromobenzoic acid
Name: 2-amino-4-bromobenzoic acid
Synonyms:
General Information
Product Number: 20776505

CAS Registry Number 20776-50-5
Name:
Benzoic acid, 2-?amino-?4-?bromo-
Anthranilic acid, 4-bromo- (6CI,7CI,8CI)
2-Amino-4-bromobenzoic acid
4-Bromoanthranilic acid
5-Bromo-2-carboxyaniline

 

Chemical Formula: C7H6BrNO2
Exact Mass: 214.96
Molecular Weight: 216.03
m/z: 214.96 (100.0%), 216.96 (98.0%), 215.96 (8.1%), 217.96 (7.5%)

 

InChI:InChI=1S/C7H6BrNO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,9H2,(H,10,11)

InChI Key:BNNICQAVXPXQAH-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=C(C=C1Br)N)C(=O)O

 

Thermal Properties Value Condition Note
Melting Point 225-226 °C   (1)CAS
Melting Point 223.5-224.5 °C   (1)CAS
Melting Point 222-223 °C   (2)CAS
Melting Point 222 °C   (3)CAS
Melting Point 221-222 °C   (4)CAS
Melting Point 219.0-219.5 °C   (5)CAS
Melting Point 217-218 °C   (6)CAS

Specification

98%
References
  1. (1) Inagaki, Sigenobu; Yakugaku Zasshi 1938, V58, P961-75 CAPLUS
  2. (2) Boojamra, Constantine G.; Journal of Organic Chemistry 1997, V62(5), P1240-1256 CAPLUS
  3. (3) Frejka, J.; Collection of Czechoslovak Chemical Communications 1935, V7, P436-43 CAPLUS
  4. (4) Da Settimo, Antonio; Gazzetta Chimica Italiana 1967, V97(8), P1304-16 CAPLUS
  5. (5) Steck, Edgar A.; Journal of the American Chemical Society 1946, V68, P380-3 CAPLUS
  6. (6) Dunn, G. E.; Canadian Journal of Chemistry 1961, V39, P285-96 CAPLUS
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