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1-Methyl-1H-pyrazole-3-carboxylic acid

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Name

1-Methyl-1H-pyrazole-3-carboxylic acid

EINECS N/A
CAS No. 25016-20-0 Density 1.34 g/cm3
PSA 55.12000 LogP 0.11830
Solubility N/A Melting Point 150-152 oC
Formula C5H6N2O2 Boiling Point 306.9 °C at 760 mmHg
Molecular Weight 126.115 Flash Point 139.4 °C
Transport Information N/A Appearance N/A
Safety 22-26-36/37/39 Risk Codes 22-36/37/38
Molecular Structure Molecular Structure of 25016-20-0 (1-Methyl-1H-pyrazole-3-carboxylic acid) Hazard Symbols HarmfulXn, IrritantXi
Synonyms

Pyrazole-3-carboxylicacid, 1-methyl- (8CI);1-Methylpyrazole-3-carboxylic acid;

Article Data 3

1-Methyl-1H-pyrazole-3-carboxylic acid Chemical Properties


IUPAC Name: 1-Methylpyrazole-3-carboxylic acid
Molecular Formula: C5H6N2O2
Molecular Weight: 126.11 g/mol
Canonical SMILES:  CN1C=CC(=N1)C(=O)O
InChI: InChI=1S/C5H6N2O2/c1-7-3-2-4(6-7)5(8)9/h2-3H,1H3,(H,8,9)
Product Categories: Building Blocks; Pyrazole
XLogP3-AA: 0.1  
H-Bond Donor: 1  
H-Bond Acceptor: 3
Index of Refraction: 1.59 
Molar Refractivity: 31.56 cm3 
Molar Volume: 93.4 cm3 
Polarizability: 12.51×10-24 cm3 
Surface Tension: 51.4 dyne/cm 
Density: 1.34 g/cm3 
Flash Point: 139.4 °C 
Enthalpy of Vaporization: 57.8 kJ/mol 
Boiling Point: 306.9 °C at 760 mmHg 
Melting Point: 150-152 °C
Vapour Pressure of 1-Methyl-1H-pyrazole-3-carboxylic acid (CAS NO.25016-20-0): 0.000326 mmHg at 25 °C

1-Methyl-1H-pyrazole-3-carboxylic acid Safety Profile

Hazard Codes: IrritantXi,HarmfulXn
Risk Statements: 22-36/37/38 
R22: Harmful if swallowed. 
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 22-26-36/37/39 
S22: Do not breathe dust. 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.
HazardClass of 1-Methyl-1H-pyrazole-3-carboxylic acid (CAS NO.25016-20-0): IRRITANT

1-Methyl-1H-pyrazole-3-carboxylic acid Specification

 1-Methyl-1H-pyrazole-3-carboxylic acid (CAS NO.25016-20-0), its Synonyms are 1H-pyrazole-3-carboxylic acid, 1-methyl- ; N-Methylpyrazole-3-carboxylic acid ; Pyrazole-3-carboxylic acid, 1-methyl- .

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