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CAS Number: 7113-10-2
2-phenylthiazole-4-carboxylic acid

Structure

 2-phenylthiazole-4-carboxylic acid
Name: 2-phenylthiazole-4-carboxylic acid
Synonyms:
General Information
Product Number: 7113102

CAS Registry Number 7113-10-2
Name:
4-?Thiazolecarboxylic acid, 2-?phenyl-
2-Phenyl-4-thiazolecarboxylic acid
2-Phenyl-1,3-thiazole-4-carboxylic acid

 

Chemical Formula: C10H7NO2S
Exact Mass: 205.02
Molecular Weight: 205.23
m/z: 205.02 (100.0%), 206.02 (12.1%), 207.02 (5.1%)

 

InChI:InChI=1S/C10H7NO2S/c12-10(13)8-6-14-9(11-8)7-4-2-1-3-5-7/h1-6H,(H,12,13)

InChI Key:IBUSLNJQKLZPNR-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C(C=C1)C2=NC(=CS2)C(=O)O

 

Thermal Properties Value Condition Note
Melting Point 175-176 °C Solv: water (7732-18-5) (2)CAS
Melting Point 175 °C   (3)CAS
Melting Point 172-175 °C   (4)IC
Melting Point 172 °C   (5)CAS
Melting Point 170-172 °C   (6)CAS

Specification

98%
References
  1. (2) Silberg, Alexandru; Chemische Berichte 1961, V94, P2887-94 CAPLUS
  2. (3) Angyal, S. J.; Journal of the Chemical Society 1953, P1740-1 CAPLUS
  3. (4) Yoshinaga, Junji; EP 262873 A1 1988 CAPLUS
  4. (5) Erlenmeyer, H.; Helvetica Chimica Acta 1944, V27, P1432-6 CAPLUS
  5. (6) Hall, G. E.; Journal of the Chemical Society [Section] C: Organic 1966, (6), P1357-60 CAPLUS
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