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CAS Number: 585-70-6
5-bromofuran-2-carboxylic acid

Structure

5-bromofuran-2-carboxylic acid
Name: 5-bromofuran-2-carboxylic acid
Synonyms:
General Information
Product Number: 585706

CAS Registry Number 585-70-6
Name:
2-​Furancarboxylic acid, 5-​bromo-
2-Furoic acid, 5-bromo- (6CI,7CI,8CI)
5-Bromo-2-furancarboxylic acid
5-Bromo-2-furanoic acid
5-Bromo-2-furoic acid
5-Bromofuroic acid

 

Chemical Formula: C5H3BrO3
Exact Mass: 189.93
Molecular Weight: 190.98
m/z: 189.93 (100.0%), 191.92 (97.3%), 190.93 (5.6%), 192.93 (5.4%)

 

InChI:InChI=1S/C5H3BrO3/c6-4-2-1-3(9-4)5(7)8/h1-2H,(H,7,8)

InChI Key:YVTQHZDUDUCGRD-UHFFFAOYSA-N

Canonical SMILES:C1=C(OC(=C1)Br)C(=O)O

 

Thermal Properties Value Condition Note
Melting Point 190-191 °C   (8)CAS
Melting Point 187 °C   (9)CAS
Melting Point 186-187 °C   (10)CAS
Melting Point 186 °C   (11)CAS
Melting Point 186 °C Solv: heptane (142-82-5) (7)IC
Melting Point 185-186 °C   (12)CAS

Specification

98%

References
  1. (7) Shapiro, Yu. M.; Khimiya Geterotsiklicheskikh Soedinenii 1990, (6), P741-4 CAPLUS
  2. (8) Raiford, L. Chas.; Journal of Organic Chemistry 1941, V6, P858-66 CAPLUS
  3. (9) Nazarova, Z. N.; Zhurnal Obshchei Khimii 1960, V30, P2322-6 CAPLUS
  4. (10) Mabry, Tom J.; Journal of Organic Chemistry 1963, V28, P1699-1700 CAPLUS
  5. (11) Whittaker, Roland M.; Recueil des Travaux Chimiques des Pays-Bas et de la Belgique 1933, V52, P352-6 CAPLUS
  6. (12) Bailey, Philip S.; Journal of Organic Chemistry 1950, V15, P159-61 CAPLUS
  7. (13) Kochetkov, N. K.; Vestnik Moskovskogo Universiteta, Seriya Matematiki, Mekhaniki, Astronomii, Fiziki, Khimii 1958, V13(No. 5), P119-22 CAPLUS
  8. (14) Shepard, A. F.; Journal of the American Chemical Society 1930, V52, P2083-90 CAPLUS
  9. (15) Obata, Yataro; Nippon Nogei Kagaku Kaishi 1940, V16;16, P184-6;38-9 CAPLUS
  10. (16) Mndzhoyan, A. L.; Zhurnal Obshchei Khimii 1946, V16, P767-70 CAPLUS
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