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CAS Number: 57489-77-7
5,7-dichloropyrazolo[1,5-a]pyrimidine

Structure

5,7-dichloropyrazolo[1,5-a]pyrimidine
Name: 5,7-dichloropyrazolo[1,5-a]pyrimidine
Synonyms:
General Information
Product Number: 57489777
CAS Registry Number: 57489-77-7
Name:
        Pyrazolo[1,​5-​a]​pyrimidine, 5,​7-​dichloro-
        5,​7-​Dichloropyrazolo[1,​5-​a]​pyrimidine 
 
Chemical Formula: C6H3Cl2N3
Exact Mass: 186.97
Molecular Weight: 188.01
m/z: 186.97 (100.0%), 188.97 (64.0%), 190.96 (10.2%), 187.97 (7.6%), 189.97 (4.2%)
Elemental Analysis: C, 38.33; H, 1.61; Cl, 37.71; N, 22.35
 
InChI: InChI=1S/C6H3Cl2N3/c7-4-3-5(8)11-6(10-4)1-2-9-11/h1-3H
InChIKey: JMTFWCYVZOFHLR-UHFFFAOYSA-N
Canonical SMILES : C1=C2N=C(C=C(N2N=C1)Cl)Cl
 
Thermal Properties Value Condition Note
Melting Point 68-71 °C Solv: ethanol (64-17-5) (2)IC

Specification

98%

References
  1. (1) Paruch, Kamil; ACS Medicinal Chemistry Letters 2010, V1(5), P204-208 CAPLUS
  2. (2) Novinson, Thomas; Journal of Medicinal Chemistry 1976, V19(4), P512-16 CAPLUS
  3. (3) Saito, Tetsuji; Bioorganic & Medicinal Chemistry 2011, V19(20), P5955-5966 CAPLUS
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