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CAS Number: 1079-46-5
methyl 5-chloro-1H-indazole-3-carboxylate

Structure

methyl 5-chloro-1H-indazole-3-carboxylate
Name: methyl 5-chloro-1H-indazole-3-carboxylate
Synonyms:
General Information
Product Number: 1079465
CAS Registry Number: 1079-46-5
Name:
1H-​Indazole-​3-​carboxylic acid, 5-​chloro-​, methyl ester
Methyl 5-​chloro-​1H-​indazole-​3-​carboxylate 
 
Chemical Formula: C9H7ClN2O2
Exact Mass: 210.02
Molecular Weight: 210.62
m/z: 210.02 (100.0%), 212.02 (32.4%), 211.02 (10.5%), 213.02 (3.2%)
Elemental Analysis: C, 51.32; H, 3.35; Cl, 16.83; N, 13.30; O, 15.19
 
InChI: InChI=1S/C9H7ClN2O2/c1-14-9(13)8-6-4-5(10)2-3-7(6)11-12-8/h2-4H,1H3,(H,11,12)
InChIKey: OFHGAYNAKIWVOL-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=NNC2=C1C=C(C=C2)Cl
 
Thermal Properties Value Condition Note
Melting Point 212 °C   (1)CAS
Melting Point 207 °C   (2)CAS

Specification

98%

References
  1. (1) Schmidt, Andreas; European Journal of Organic Chemistry 2007, (29), P4909-4916 CAPLUS
  2. (2) Buu-Hoi, N. P.; Journal of Heterocyclic Chemistry 1964, V1(5), P239-41 CAPLUS
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