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CAS Number: 1759-24-6
ethyl 5-amino-1-isopropyl-1H-pyrazole-4-carboxylate

Structure

ethyl 5-amino-1-isopropyl-1H-pyrazole-4-carboxylate
Name: ethyl 5-amino-1-isopropyl-1H-pyrazole-4-carboxylate
Synonyms:
General Information
Product Number: 1759246

CAS Registry Number 1759-24-6
Name:
1H-​Pyrazole-​4-​carboxylic acid, 5-​amino-​1-​(1-​methylethyl)​-​, ethyl ester
Pyrazole-4-carboxylic acid, 5-amino-1-isopropyl-, ethyl ester (6CI,7CI,8CI)
2-Isopropyl-3-amino-4-carbethoxypyrazole

 

Chemical Formula: C9H15N3O2
Exact Mass: 197.12
Molecular Weight: 197.23
m/z: 197.12 (100.0%), 198.12 (10.0%), 198.11 (1.1%)

 

InChI:InChI=1S/C9H15N3O2/c1-4-14-9(13)7-5-11-12(6(2)3)8(7)10/h5-6H,4,10H2,1-3H3

InChI Key:OFSRMXPYRMMISS-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)C1=C(N(N=C1)C(C)C)N

 

Thermal Properties Value Condition Note
Boiling Point 164-166 °C Press: 10 Torr (1)CAS
Boiling Point 164-166 °C Press: 10 Torr (2)CAS
Boiling Point 164-166 °C Press: 10 Torr (3)CAS
Boiling Point 164-166 °C Press: 10 Torr (4)CAS
Boiling Point 164-166 °C Press: 10 Torr (5)CAS
Melting Point 61 °C   (6)CAS
Melting Point 46-48 °C   (2)CAS
Melting Point 46-48 °C   (3)CAS
Melting Point 46-48 °C   (4)CAS

Specification

98%

References
  1. (1) Druey, Jean; CH 377834 1964 CAPLUS
  2. (2) Druey, Jean; DE 1056613 1959 CAPLUS
  3. (3) Druey, Jean; US 2980677 1961 CAPLUS
  4. (4) Druey, Jean; DE 1092922 1958 CAPLUS
  5. (5) GB 889146 1962 CAPLUS
  6. (6) Schmidt, P.; Helvetica Chimica Acta 1959, V42, P763-72 CAPLUS
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