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| Name |
9H-Purine,6-chloro-8-ethoxy- |
EINECS | N/A |
| CAS No. | 7498-25-1 | Density | 1.62 g/cm3 |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C7H7ClN4O | Boiling Point | 275.4 °C at 760 mmHg |
| Molecular Weight | 198.612 | Flash Point | 120.4 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1H-Purine,6-chloro-8-ethoxy- (9CI);Purine, 6-chloro-8-ethoxy- (7CI);NSC 407406; |
9H-Purine,6-chloro-8-ethoxy- Specification
The 9H-Purine,6-chloro-8-ethoxy- is an organic compound with the formula C7H7ClN4O. With the CAS registry number 7498-25-1, the systematic name of this chemical is 6-chloro-8-ethoxy-5H-purine.
Physical properties about 9H-Purine,6-chloro-8-ethoxy- are: (1)ACD/LogP: 1.06; (2)#H bond acceptors: 5; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 58.67 Å2; (5)Index of Refraction: 1.711; (6)Molar Refractivity: 47.72 cm3; (7)Molar Volume: 121.9 cm3; (8)Polarizability: 18.91×10-24cm3; (9)Surface Tension: 56.5 dyne/cm; (10)Density: 1.62 g/cm3; (11)Flash Point: 120.4 °C; (12)Enthalpy of Vaporization: 49.32 kJ/mol; (13)Boiling Point: 275.4 °C at 760 mmHg; (14)Vapour Pressure: 0.00856 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl/C1=N/C=N\C2=N\C(OCC)=N/C12
(2)InChI: InChI=1/C7H7ClN4O/c1-2-13-7-11-4-5(8)9-3-10-6(4)12-7/h3-4H,2H2,1H3
(3)InChIKey: KVOPDCCJPJPVDL-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C7H7ClN4O/c1-2-13-7-11-4-5(8)9-3-10-6(4)12-7/h3-4H,2H2,1H3
(5)Std. InChIKey: KVOPDCCJPJPVDL-UHFFFAOYSA-N
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