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CAS No.: | 40790-21-4 |
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Name: | 2,3-DIMETHYL-5-ISOPROPYLPYRAZINE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C9H14N2 |
Molecular Weight: | 150.224 |
Synonyms: | 2,3-Dimethyl-5-isopropylpyrazine;5-Isopropyl-2,3-dimethylpyrazine; |
Density: | 0.947 g/cm3 |
Boiling Point: | 206.9 °C at 760 mmHg |
Flash Point: | 77 °C |
PSA: | 25.78000 |
LogP: | 2.21680 |
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The Pyrazine,2,3-dimethyl-5-(1-methylethyl)- is an organic compound with the formula C9H14N2. The systematic name of this chemical is 2,3-dimethyl-5-(propan-2-yl)pyrazine. With the CAS registry number 40790-21-4, it is also named as 5-Isopropyl-2,3-dimethylpyrazine. The product's category is Isopropyl.
Physical properties about Pyrazine,2,3-dimethyl-5-(1-methylethyl)- are: (1)ACD/LogP: 1.98; (2)ACD/LogD (pH 5.5): 1.98; (3)ACD/LogD (pH 7.4): 1.98; (4)ACD/BCF (pH 5.5): 18.8; (5)ACD/BCF (pH 7.4): 18.82; (6)ACD/KOC (pH 5.5): 284.19; (7)ACD/KOC (pH 7.4): 284.4; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 25.78 Å2; (11)Index of Refraction: 1.495; (12)Molar Refractivity: 46.27 cm3; (13)Molar Volume: 158.5 cm3; (14)Polarizability: 18.34×10-24cm3; (15)Surface Tension: 35.1 dyne/cm; (16)Density: 0.947 g/cm3; (17)Flash Point: 77 °C; (18)Enthalpy of Vaporization: 42.5 kJ/mol; (19)Boiling Point: 206.9 °C at 760 mmHg; (20)Vapour Pressure: 0.334 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: n1cc(nc(c1C)C)C(C)C
(2)InChI: InChI=1/C9H14N2/c1-6(2)9-5-10-7(3)8(4)11-9/h5-6H,1-4H3
(3)InChIKey: JTIYGJBEUZEJAB-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C9H14N2/c1-6(2)9-5-10-7(3)8(4)11-9/h5-6H,1-4H3
(5)Std. InChIKey: JTIYGJBEUZEJAB-UHFFFAOYSA-N