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Cas Database |
| Name |
Ethyl 5-amino-4-cyano-1-phenyl-1H-pyrazole-3-carboxylate |
EINECS | N/A |
| CAS No. | 93764-93-3 | Density | 1.302 g/cm3 |
| PSA | 93.93000 | LogP | 2.08408 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C13H12N4O2 | Boiling Point | 495.669 °C at 760 mmHg |
| Molecular Weight | 256.264 | Flash Point | 253.572 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
5-Amino-4-cyano-1-phenyl-1H-pyrazole-3-carboxylic acid ethyl ester; |
Article Data | 3 |
Ethyl 5-amino-4-cyano-1-phenyl-1H-pyrazole-3-carboxylate Chemical Properties
Molecular Structure of Ethyl 5-amino-4-cyano-1-phenyl-1H-pyrazole-3-carboxylate (CAS No.93764-93-3):
Molecular Formula: C13H12N4O2
Molecular Weight: 256.26
CAS No: 93764-93-3
H bond acceptors: 6
H bond donors: 2
Freely Rotating Bonds: 5
Polar Surface Area: 93.93 Å2
Index of Refraction: 1.632
Molar Refractivity: 70.254 cm3
Molar Volume: 196.876 cm3
Surface Tension: 53.403 dyne/cm
Density: 1.302 g/cm3
Flash Point: 253.572 °C
Enthalpy of Vaporization: 76.327 kJ/mol
Boiling Point: 495.669 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C
Systematic Name: Ethyl 5-amino-4-cyano-1-phenyl-1H-pyrazole-3-carboxylate
InChI: InChI=1/C13H12N4O2/c1-2-19-13(18)11-10(8-14)12(15)17(16-11)9-6-4-3-5-7-9/h3-7H,2,15H2,1H3
InChIKey: IEBFWSOLRJKQQN-UHFFFAOYAL
Std. InChI: InChI=1S/C13H12N4O2/c1-2-19-13(18)11-10(8-14)12(15)17(16-11)9-6-4-3-5-7-9/h3-7H,2,15H2,1H3
Std. InChIKey: IEBFWSOLRJKQQN-UHFFFAOYSA-N
Product Categories: Pyrazole
Ethyl 5-amino-4-cyano-1-phenyl-1H-pyrazole-3-carboxylate Specification
Ethyl 5-amino-4-cyano-1-phenyl-1H-pyrazole-3-carboxylate (CAS No.93764-93-3), its synonyms are 1H-Pyrazole-3-carboxylic acid, 5-amino-4-cyano-1-phenyl-, ethyl ester ; 5-Amino-4-cyano-1-phenyl-1H-Pyrazole-3-carboxylic acid ethyl ester .
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