3-Methoxy-2,5-dimethylpyrazine supplier

Name
2-methoxy-3,6-dimethylpyrazine,3-methoxy-2,5-dimethylpyrazine
EINECS
CAS No. 19846-22-1
Article Data2
CAS DataBase
Density 1.043 g/cm³
Solubility
Melting Point
Formula C₇H₁₀N₂O
Boiling Point 179.3 °C at 760 mmHg
Molecular Weight 138.169
Flash Point 62.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Methoxy-3,6-dimethylpyrazine;3-Methoxy-2,5-dimethylpyrazine;
PSA 35.01000
LogP 1.10200

3-Methoxy-2,5-dimethylpyrazine Specification

The systematic name of 3-Methoxy-2,5-dimethylpyrazine is 3-methoxy-2,5-dimethylpyrazine. With the CAS registry number 19846-22-1, it is also named as Pyrazine,3-methoxy-2,5-dimethyl-. In addition, its molecular formula is C₇H₁₀N₂O and molecular weight is 138.1671.

The other characteristics of 3-Methoxy-2,5-dimethylpyrazine can be summarized as: (1)ACD/LogP: 1.67; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.67; (4)ACD/LogD (pH 7.4): 1.67; (5)ACD/BCF (pH 5.5): 10.98; (6)ACD/BCF (pH 7.4): 10.99; (7)ACD/KOC (pH 5.5): 193.45; (8)ACD/KOC (pH 7.4): 193.48; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 35.01 Å²; (13)Index of Refraction: 1.497; (14)Molar Refractivity: 38.76 cm³; (15)Molar Volume: 132.4 cm³; (16)Polarizability: 15.36×10^-24cm³; (17)Surface Tension: 37.4 dyne/cm; (18)Density: 1.043 g/cm³; (19)Flash Point: 62.7 °C; (20)Enthalpy of Vaporization: 39.85 kJ/mol; (21)Boiling Point: 179.3 °C at 760 mmHg; (22)Vapour Pressure: 1.29 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: O(c1nc(cnc1C)C)C
(2)InChI: InChI=1/C7H10N2O/c1-5-4-8-6(2)7(9-5)10-3/h4H,1-3H3
(3)InChIKey: QYRGVELVPYDICQ-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C7H10N2O/c1-5-4-8-6(2)7(9-5)10-3/h4H,1-3H3
(5)Std. InChIKey: QYRGVELVPYDICQ-UHFFFAOYSA-N

Product Name

2-methoxy-3,6-dimethylpyrazine,3-methoxy-2,5-dimethylpyrazine

3-Methoxy-2,5-dimethylpyrazine Specification

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