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179057-12-6

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Basic Information
CAS No.: 179057-12-6
Name: Methyl 4-(1-methyl-1H-pyrazol-5-yl)benzoate
Article Data: 6
Molecular Structure:
Molecular Structure of 179057-12-6 (Methyl 4-(1-methyl-1H-pyrazol-5-yl)benzoate)
Formula: C12H12 N2 O2
Molecular Weight: 216.239
Synonyms: Methyl 4-(1-methyl-1H-pyrazol-5-yl)benzoate
Density: 1.16
Boiling Point: 357.507°C at 760 mmHg
Flash Point: 170.015°C
PSA: 44.12000
LogP: 1.87370
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Chemistry

Molecular structure of Methyl 4-(1-methyl-1H-pyrazol-5-yl)benzoate (CAS NO.179057-12-6) is:

Product Name: Methyl 4-(1-methyl-1H-pyrazol-5-yl)benzoate
CAS Registry Number: 179057-12-6
Systematic Name: Methyl 4-(1-methyl-1H-pyrazol-5-yl)benzoate
Molecular Formula: C12H12N2O2
Molecular Weight: 216.24
Index of Refraction: 1.576 
Molar Refractivity: 61.63 cm3 
Molar Volume: 186.313 cm3
Surface Tension: 41.106 dyne/cm 
Density: 1.161 g/cm3 
Flash Point: 170.015 °C 
Enthalpy of Vaporization: 60.289 kJ/mol 
Boiling Point: 357.507 °C at 760 mmHg 
Vapour Pressure: 0 mmHg at 25 °C 
SMILES: O=C(OC)c2ccc(c1ccnn1C)cc2 
InChI: InChI=1/C12H12N2O2/c1-14-11(7-8-13-14)9-3-5-10(6-4-9)12(15)16-2/h3-8H,1-2H3
InChIKey: PYEWEFGLTSTRFG-UHFFFAOYAG 
Std. InChI: InChI=1S/C12H12N2O2/c1-14-11(7-8-13-14)9-3-5-10(6-4-9)12(15)16-2/h3-8H,1-2H3 
Std. InChIKey: PYEWEFGLTSTRFG-UHFFFAOYSA-N 

Specification

 Methyl 4-(1-methyl-1H-pyrazol-5-yl)benzoate , its cas register number is 179057-12-6. It also can be called Benzoic acid,4-(1-methyl-1H-pyrazol-5-yl)-, methyl ester .