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| CAS No.: | 190274-15-8 |
|---|---|
| Name: | 2-Amino-7-bromoquinazoline |
| Molecular Structure: | |
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| Formula: | C8H6BrN3 |
| Molecular Weight: | 224.06 |
| Synonyms: | 2-Amino-7-bromoquinazoline;7-Bromoquinazolin-2-amine; |
| Density: | 1.744 g/cm3 |
| Boiling Point: | 425.339 °C at 760 mmHg |
| Flash Point: | 211.038 °C |
| PSA: | 51.80000 |
| LogP: | 2.55570 |
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Specification
The 2-Quinazolinamine,7-bromo- is an organic compound with the formula C8H6BrN3. The systematic name of this chemical is 7-Bromoquinazolin-2-amine. With the CAS registry number 190274-15-8, it is also named as 2-Amino-7-bromoquinazoline. The category of the product is API intermediates. Besides, its molecular weight is 224.05734.
The physical properties of 2-Quinazolinamine,7-bromo- are: (1)ACD/LogP: 2.30; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 8; (5)ACD/BCF (pH 7.4): 10; (6)ACD/KOC (pH 5.5): 151; (7)ACD/KOC (pH 7.4): 179; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)Polar Surface Area: 51.8 Å2; (11)Index of Refraction: 1.747; (12)Molar Refractivity: 52.204 cm3; (13)Molar Volume: 128.462 cm3; (14)Polarizability: 20.695×10-24 cm3; (15)Surface Tension: 73.184 dyne/cm; (16)Density: 1.744 g/cm3; (17)Flash Point: 211.038 °C; (18)Enthalpy of Vaporization: 67.997 kJ/mol; (19)Boiling Point: 425.339 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc2ccc1c(nc(nc1)N)c2
(2)InChI: InChI=1/C8H6BrN3/c9-6-2-1-5-4-11-8(10)12-7(5)3-6/h1-4H,(H2,10,11,12)
(3)InChIKey: CFUQBLOSOCYEIG-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C8H6BrN3/c9-6-2-1-5-4-11-8(10)12-7(5)3-6/h1-4H,(H2,10,11,12)
(5)Std. InChIKey: CFUQBLOSOCYEIG-UHFFFAOYSA-N