3-Methylpyrazine-2-carboxylic acid supplier

Name
3-METHYLPYRAZINE-2-CARBOXYLIC ACID
EINECS
CAS No. 41110-28-5
Article Data5
CAS DataBase
Density 1.319 g/cm³
Solubility
Melting Point 177℃ (DEC.)
Formula C₆H₆N₂O₂
Boiling Point 299.334 °C at 760 mmHg
Molecular Weight 138.126
Flash Point 134.832 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Pyrazinecarboxylicacid, 3-methyl- (9CI);Pyrazinoic acid, 3-methyl- (6CI);2-Methylpyrazine-3-carboxylic acid;3-Methylpiperazine-2-carboxylic acid;3-Methylpyrazine-2-carboxylic acid;3-Methylpyrazinoic acid;
PSA 63.08000
LogP 0.48320

3-Methylpyrazine-2-carboxylic acid Specification

The CAS register number of 2-Pyrazinecarboxylicacid, 3-methyl- is 41110-28-5. It also can be called as 3-Methylpyrazinoic acid and the IUPAC name about this chemical is 3-methylpyrazine-2-carboxylic acid. The molecular formula about this chemical is C₆H₆N₂O₂ and the molecular weight is 138.12404.

Physical properties about 2-Pyrazinecarboxylicacid, 3-methyl- are: (1)ACD/LogP: -0.22; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 63.08Å²; (10)Index of Refraction: 1.567; (11)Molar Refractivity: 34.19 cm³; (12)Molar Volume: 104.686 cm³; (13)Polarizability: 13.554x10^-24cm³; (14)Surface Tension: 63.35 dyne/cm; (15)Flash Point: 134.832 °C; (16)Enthalpy of Vaporization: 56.952 kJ/mol; (17)Boiling Point: 299.334 °C at 760 mmHg; (18)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1nccnc1C
(2)InChI: InChI=1/C6H6N2O2/c1-4-5(6(9)10)8-3-2-7-4/h2-3H,1H3,(H,9,10)
(3)InChIKey: DEDJQZNLAXYJBT-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C6H6N2O2/c1-4-5(6(9)10)8-3-2-7-4/h2-3H,1H3,(H,9,10)
(5)Std. InChIKey: DEDJQZNLAXYJBT-UHFFFAOYSA-N

Product Name

3-METHYLPYRAZINE-2-CARBOXYLIC ACID

3-Methylpyrazine-2-carboxylic acid Specification

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