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CAS No.: | 5734-67-8 |
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Name: | 4-CHLORO-6-ETHYL-2-PYRIMIDINAMINE |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C6H8ClN3 |
Molecular Weight: | 157.603 |
Synonyms: | Pyrimidine,2-amino-4-chloro-6-ethyl- (7CI,8CI);2-Amino-4-chloro-6-ethylpyrimidine;4-Chloro-6-ethylpyrimidin-2-ylamine; |
Density: | 1.282 g/cm3 |
Boiling Point: | 319.988 °C at 760 mmHg |
Flash Point: | 147.324 °C |
PSA: | 51.80000 |
LogP: | 1.85580 |
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The CAS register number of 2-Amino-4-chloro-6-ethylpyrimidine is 5734-67-8. It also can be called as 2-Pyrimidinamine,4-chloro-6-ethyl- and the systematic name about this chemical is 4-chloro-6-ethylpyrimidin-2-amine. The molecular formula about this chemical is C6H8ClN3 and the molecular weight is 157.60. It belongs to the Drug Intermediates.
Physical properties about 2-Amino-4-chloro-6-ethylpyrimidine are: (1)ACD/LogP: 1.26; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 6; (5)ACD/BCF (pH 7.4): 6; (6)ACD/KOC (pH 5.5): 132; (7)ACD/KOC (pH 7.4): 132; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 51.8Å2; (12)Index of Refraction: 1.584; (13)Molar Refractivity: 41.116 cm3; (14)Molar Volume: 122.929 cm3; (15)Polarizability: 16.3x10-24cm3; (16)Surface Tension: 54.41 dyne/cm; (17)Enthalpy of Vaporization: 56.162 kJ/mol; (18)Boiling Point: 319.988 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: CCc1cc(Cl)nc(N)n1
(2)InChI: InChI=1/C6H8ClN3/c1-2-4-3-5(7)10-6(8)9-4/h3H,2H2,1H3,(H2,8,9,10)
(3)InChIKey: GZOWPTJWHDWHPK-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C6H8ClN3/c1-2-4-3-5(7)10-6(8)9-4/h3H,2H2,1H3,(H2,8,9,10)
(5)Std. InChIKey: GZOWPTJWHDWHPK-UHFFFAOYSA-N