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13627-49-1

Basic Information
CAS No.: 13627-49-1
Name: 2-Methyl-4-pyrimidinecarboxylic acid
Molecular Structure:
Molecular Structure of 13627-49-1 (2-Methyl-4-pyrimidinecarboxylic acid)
Formula: C6H6N2O2
Molecular Weight: 138.126
Synonyms: 2-Methyl-4-pyrimidinecarboxylicacid;
EINECS: 806-021-9
Density: 1.319 g/cm3
Melting Point: 204-206 °C
Boiling Point: 292.511 °C at 760 mmHg
Flash Point: 130.706 °C
Hazard Symbols: Xi
Risk Codes: 36/38
Safety: 26
PSA: 63.08000
LogP: 0.48320
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Chemistry

Product Name: 2-Methylpyrimidine-4-carboxylic acid (CAS NO.13627-49-1)


Molecular Formula: C6H6N2O2
Molecular Weight: 138.12404g/mol
Mol File: 13627-49-1.mol
Boiling point: 292.5 °C at 760 mmHg
Flash Point: 130.7 °C
Density: 1.319 g/cm3
Surface Tension: 63.3 dyne/cm
Enthalpy of Vaporization: 56.19 kJ/mol
Vapour Pressure: 0.000834 mmHg at 25°C
XLogP3-AA: 0.5
H-Bond Donor: 1
H-Bond Acceptor: 4
Structure Descriptors of 2-Methylpyrimidine-4-carboxylic acid (CAS NO.13627-49-1):
  IUPAC Name: 2-methylpyrimidine-4-carboxylic acid
  Canonical SMILES: CC1=NC=CC(=N1)C(=O)O
  InChI: InChI=1S/C6H6N2O2/c1-4-7-3-2-5(8-4)6(9)10/h2-3H,1H3,(H,9,10) 
  InChIKey: CDBDBWCUGHXFTN-UHFFFAOYSA-N
Product Categories: PYRIMIDINE; Pyrimidine series

Specification

 2-Methylpyrimidine-4-carboxylic acid , its CAS NO. is 13627-49-1, the synonym is 2-Methyl-4-pyrimidinecarboxylic acid .