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CAS No.: | 166524-66-9 |
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Name: | 2-Ethoxy-4-fluoro-6-hydrazinopyrimidine |
Molecular Structure: | |
Formula: | C6H9FN4O |
Molecular Weight: | 172.16000 |
Synonyms: | 4(1H)-Pyrimidinone,2-ethoxy-6-fluoro-, hydrazone (9CI);2-Ethoxy-4-fluoro-6-hydrazinopyrimidine; |
Density: | 1.43 |
Boiling Point: | 336.807 °C at 760 mmHg |
Flash Point: | 95.9 ºC |
PSA: | 73.06000 |
LogP: | 1.07330 |
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The 2-Ethoxy-4-fluoro-6-hydrazinopyrimidine with cas registry number of 166524-66-9, has the systematic name of 2-ethoxy-4-fluoro-6-hydrazinopyrimidine. And it is also named 2-Ethoxy-4-fluoro-6-hydrazinopyrimidine.
Physical properties about this chemical are: (1)ACD/LogP: 1.27; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 33; (8)ACD/KOC (pH 7.4): 33; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 73.06 Å2; (13)Index of Refraction: 1.579; (14)Molar Refractivity: 42.252 cm3; (15)Molar Volume: 127.227 cm3; (16)Polarizability: 16.75×10-24cm3; (17)Surface Tension: 55.52 dyne/cm; (18)Enthalpy of Vaporization: 58 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CCOc1nc(F)cc(NN)n1;
(2)InChI: InChI=1/C6H9FN4O/c1-2-12-6-9-4(7)3-5(10-6)11-8/h3H,2,8H2,1H3,(H,9,10,11);
(3)InChIKey: JFXLELUXFCPFRP-UHFFFAOYAG;
(4)Std. InChI: InChI=1S/C6H9FN4O/c1-2-12-6-9-4(7)3-5(10-6)11-8/h3H,2,8H2,1H3,(H,9,10,11);
(5)Std. InChIKey: JFXLELUXFCPFRP-UHFFFAOYSA-N