-
Name
3-[(6-Methylpyrazin-2-yl)oxy]benzyl chloride
- EINECS
- CAS No. 912569-64-3
- Density 1.232 g/cm3
- Solubility
- Melting Point
- Formula C12H11ClN2O
- Boiling Point 354.8 °C at 760 mmHg
- Molecular Weight 234.68
- Flash Point 168.4 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
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Molecular Structure
- Hazard Symbols C
- Synonyms 2-[3-(Chloromethyl)phenoxy]-6-methylpyrazine;3-[(6-Methylpyrazin-2-yl)oxy]benzyl chloride;3-[(6-Methylpyrazin-2-yl)oxy]benzyl chloride 97%;2-[3-(Chloromethyl)phenoxy]-6-methylpyrazine 97%;3-[(6-Methylpyrazin-2-yl)oxy]benzyl chloride, 2-[3-(Chloromethyl)phenoxy]-6-methyl-1,4-diazine
- PSA 35.01000
- LogP 3.31610
Pyrazine, 2-[3-(chloromethyl)phenoxy]-6-methyl- Specification
This chemical is called Pyrazine, 2-[3-(chloromethyl)phenoxy]-6-methyl-, and its systematic name is 2-[3-(chloromethyl)phenoxy]-6-methyl-pyrazine. With the molecular formula of C12H11ClN2O, its molecular weight is 234.68. The CAS registry number of this chemical is 912569-64-3.
Other characteristics of the Pyrazine, 2-[3-(chloromethyl)phenoxy]-6-methyl- can be summarised as followings: (1)ACD/LogP: 2.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.11; (4)ACD/LogD (pH 7.4): 2.11; (5)#H bond acceptors: 3; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 35.01 Å2; (9)Index of Refraction: 1.581; (10)Molar Refractivity: 63.46 cm3; (11)Molar Volume: 190.4 cm3; (12)Polarizability: 25.16×10-24cm3; (13)Surface Tension: 47.3 dyne/cm; (14)Density: 1.232 g/cm3; (15)Flash Point: 168.4 °C; (16)Enthalpy of Vaporization: 57.62 kJ/mol; (17)Boiling Point: 354.8 °C at 760 mmHg; (18)Vapour Pressure: 6.69E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Cc1cncc(n1)Oc2cccc(c2)CCl
2.InChI: InChI=1/C12H11ClN2O/c1-9-7-14-8-12(15-9)16-11-4-2-3-10(5-11)6-13/h2-5,7-8H,6H2,1H3
3.InChIKey: IRGHRMVBHYHQTO-UHFFFAOYAB
Related Products
- Pyrazine
- Pyrazine, 1-oxide
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- Pyrazine, 2,3,5,6-tetra-2-pyridinyl-
- Pyrazine, 2-[3-(chloromethyl)phenoxy]-6-methyl-
- Pyrazine, 2-ethyl-6-methyl-
- Pyrazine, 2-methoxy-3,5-dimethyl-
- Pyrazine,2-(1,1-dimethylethyl)-
- Pyrazine,2-(tributylstannyl)-
- Pyrazine,2,3-di-2-pyridinyl-
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