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Name |
5,7-Dichloroimidazo[1,2-a]pyrimidine |
EINECS | N/A |
CAS No. | 57473-32-2 | Density | 1.696g/cm3 |
PSA | 30.19000 | LogP | 2.03610 |
Solubility | N/A | Melting Point |
257-259°C |
Formula | C6H3Cl2N3 | Boiling Point | N/A |
Molecular Weight | 188.016 | Flash Point | N/A |
Transport Information | N/A | Appearance | Light Yellow Solid |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
5,7-DICHLORO-IMIDAZO[1,2-A]PYRIMIDINE |
Article Data | 5 |
The 5,7-Dichloro-imidazo[1,2-a]pyrimidine, with CAS registry number 57473-32-2, belongs to the following product categories: (1)Heterocyclic Compounds; (2)Bases & Related Reagents; (3)Heterocycles; (4)Nucleotides. It has the systematic name of 5,7-dichloroimidazo[1,2-a]pyrimidine. This chemical is a kind of light yellow solid. And the chemical formula of this chemical is C6H3Cl2N3.
Physical properties of 5,7-Dichloro-imidazo[1,2-a]pyrimidine: (1)ACD/LogP: 2.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.261; (4)ACD/LogD (pH 7.4): 2.261; (5)ACD/BCF (pH 5.5): 30.758; (6)ACD/BCF (pH 7.4): 30.777; (7)ACD/KOC (pH 5.5): 404.217; (8)ACD/KOC (pH 7.4): 404.474; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 30.19 Å2; (13)Index of Refraction: 1.733; (14)Molar Refractivity: 44.36 cm3; (15)Molar Volume: 110.838 cm3; (16)Polarizability: 17.586×10-24cm3; (17)Surface Tension: 59.435 dyne/cm; (18)Density: 1.696 g/cm3.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cn2c(cc(nc2n1)Cl)Cl
(2)InChI: InChI=1/C6H3Cl2N3/c7-4-3-5(8)11-2-1-9-6(11)10-4/h1-3H
(3)InChIKey: WMHORUUVAKBDSV-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C6H3Cl2N3/c7-4-3-5(8)11-2-1-9-6(11)10-4/h1-3H
(5)Std. InChIKey: WMHORUUVAKBDSV-UHFFFAOYSA-N