Product Number: 5775893
CAS Registry Number 5775-89-3
Name:
1H-?Pyrazole-?5-?carboxylic acid, 4-?bromo-?1,?3-?dimethyl-?, ethyl ester
Pyrazole-5-carboxylic acid, 4-bromo-1,3-dimethyl-, ethyl ester (7CI,8CI)
Chemical Formula: C8H11BrN2O2
Exact Mass: 246.00
Molecular Weight: 247.09
m/z: 246.00 (100.0%), 248.00 (97.8%), 247.00 (9.5%), 249.00 (9.3%)
InChI
InChI=1S/C9H14N2O2/c1-4-11-8(6-7(3)10-11)9(12)13-5-2/h6H,4-5H2,1-3H3
InChI Key:NTZFLNAMFHICLK-UHFFFAOYSA-N
Canonical SMILES:CCN1C(=CC(=N1)C)C(=O)OCC
| Thermal Properties |
Value |
Condition |
Note |
| Boiling Point |
114 °C |
Press: 2 Torr |
(1)CAS |
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