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CAS Number: 3622-04-6
benzo[d]thiazole-2-carboxylic acid

Structure

benzo[d]thiazole-2-carboxylic acid
Name: benzo[d]thiazole-2-carboxylic acid
Synonyms:
General Information
Product Number: 3622046
CAS Number:
3622-04-6
Name:
1,3-Benzothiazole-2-carboxylic acid
Formula:
C8H5NO2S
Molecular Weight:
179.20
Synonyms:
2-Carboxybenzothiazole;1,3-Benzothiazol-2-carboxylic acid;
SMILES: OC(=O)c1nc2c(s1)cccc2
InChI:   1S/C8H5NO2S/c10-8(11)7-9-5-3-1-2-4-6(5)12-7/h1-4H,(H,10,11)
InChIKey:   UUVDQMYRPUHXPB-UHFFFAOYSA-N
MDL Number: MFCD02682025
 
Melting Point 108 °C   (5)CAS
Melting Point 106-108 °C (decomp)   (6)CAS
Melting Point 106 °C (decomp)   (7)CAS
Melting Point 105 °C (decomp)   (8)CAS
Melting Point 104-106 °C (decomp)   (9)CAS
Melting Point 103-104 °C (decomp)   (10)CAS
Melting Point 92.0-92.5 °C (decomp)   (11)CAS

Specification

98%

References
  1. (1) Sawhney, Shanti N.; Journal of Organic Chemistry 1979, V44(7), P1136-42 CAPLUS
  2. (2) Vechorkin, Oleg; Organic Letters 2010, V12(15), P3567-3569 CAPLUS
  3. (3) Boogaerts, Ine I. F.; Angewandte Chemie, International Edition 2010, V49(46), P8674-8677, S8674/1-S8674/20 CAPLUS
  4. (4) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
  5. (5) Fridman, S. G.; Zhurnal Obshchei Khimii 1950, V20, P1191-8 CAPLUS
  6. (6) Zubarovskii, V. M.; Zhurnal Obshchei Khimii 1954, V24, P1664-74 CAPLUS
  7. (7) Zerweck, Werner; DE 613067 1935 CAPLUS
  8. (8) Gilman, Henry; Journal of the American Chemical Society 1949, V71, P2328-31 CAPLUS
  9. (9) Zubarovskii, V. M.; Zhurnal Obshchei Khimii 1951, V21, P2199-2205 CAPLUS
  10. (10) Tertov, B. A.; Zhurnal Obshchei Khimii 1963, V33(11), P3671-4 CAPLUS
  11. (11) Campaigne, E.; Journal of Medicinal & Pharmaceutical Chemistry 1959, V1, P577-600 CAPLUS
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