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Name |
2-Chloro-5-methylpyrazine |
EINECS | N/A |
CAS No. | 59303-10-5 | Density | 1.235 g/cm3 |
PSA | 25.78000 | LogP | 1.43840 |
Solubility | N/A | Melting Point |
N/A |
Formula | C5H5ClN2 | Boiling Point | 172.172 °C at 760 mmHg |
Molecular Weight | 128.561 | Flash Point | 72.24 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Chloro-5-methylpyrazine;5-Chloro-2-methylpyrazine; |
Article Data | 2 |
This chemical is called Pyrazine,2-chloro-5-methyl-, and its systematic name is 2-chloro-5-methylpyrazine. With the molecular formula of C5H5ClN2, its molecular weight is 128.56. The CAS registry number of this chemical is 59303-10-5.
Other characteristics of the Pyrazine,2-chloro-5-methyl- can be summarised as followings: (1)ACD/LogP: 1.09; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 4; (6)ACD/BCF (pH 7.4): 4; (7)ACD/KOC (pH 5.5): 95; (8)ACD/KOC (pH 7.4): 95; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 25.78 Å2; (13)Index of Refraction: 1.53; (14)Molar Refractivity: 32.155 cm3; (15)Molar Volume: 104.107 cm3; (16)Polarizability: 12.747×10-24cm3; (17)Surface Tension: 44.63 dyne/cm; (18)Density: 1.235 g/cm3; (19)Flash Point: 72.24 °C; (20)Enthalpy of Vaporization: 39.177 kJ/mol; (21)Boiling Point: 172.172 °C at 760 mmHg; (22)Vapour Pressure: 1.798 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Cc1cnc(Cl)cn1
2.InChI: InChI=1/C5H5ClN2/c1-4-2-8-5(6)3-7-4/h2-3H,1H3
3.InChIKey: XSDAJECCWPYVGW-UHFFFAOYAU