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CAS No.: | 38373-44-3 |
---|---|
Name: | 5-chloro-2-methoxy-pyrimidine |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C5H5ClN2O |
Molecular Weight: | 144.559 |
Synonyms: | Pyrimidine, 5-chloro-2-methoxy- (9CI);5-Chloro-2-methoxypyrimidine,purity:95% min(hplc); |
Density: | 1.292 g/cm3 |
Melting Point: | 50-55°C |
Boiling Point: | 234.5 °C at 760 mmHg |
Flash Point: | 95.6 °C |
Hazard Symbols: | Xn |
Risk Codes: | 22-41 |
Safety: | 26-39 |
PSA: | 35.01000 |
LogP: | 1.13860 |
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The CAS register number of 5-Chloro-2-methoxypyrimidine is 38373-44-3. It also can be called as Pyrimidine, 5-chloro-2-methoxy- (9CI). The molecular formula about this chemical is C5H5ClN2O and the molecular weight is 144.559. It belongs to the following product category which includes Pyrimidine.
Physical properties about 5-Chloro-2-methoxypyrimidine are: (1)ACD/LogP: 0.81; (2)ACD/LogD (pH 5.5): 0.81; (3)ACD/LogD (pH 7.4): 0.81; (4)ACD/BCF (pH 5.5): 2.45; (5)ACD/BCF (pH 7.4): 2.45; (6)ACD/KOC (pH 5.5): 66.07; (7)ACD/KOC (pH 7.4): 66.07; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 35.01 Å2; (11)Index of Refraction: 1.52; (12)Molar Refractivity: 34 cm3; (13)Molar Volume: 111.8 cm3; (14)Polarizability: 13.48x10-24cm3; (15)Surface Tension: 44 dyne/cm; (16)Density: 1.292 g/cm3; (17)Flash Point: 95.6 °C; (18)Enthalpy of Vaporization: 45.21 kJ/mol; (19)Boiling Point: 234.5 °C at 760 mmHg; (20)Vapour Pressure: 0.0805 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cnc(OC)nc1
(2)InChI: InChI=1/C5H5ClN2O/c1-9-5-7-2-4(6)3-8-5/h2-3H,1H3
(3)InChIKey: GJNGJHZIOYFEOP-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C5H5ClN2O/c1-9-5-7-2-4(6)3-8-5/h2-3H,1H3
(5)Std. InChIKey: GJNGJHZIOYFEOP-UHFFFAOYSA-N