Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
5-Methoxy-1H-pyrrolo[3,2-b]pyridine |
EINECS | N/A |
CAS No. | 17288-40-3 | Density | 1.244 g/cm3 |
PSA | 37.91000 | LogP | 1.57150 |
Solubility | N/A | Melting Point |
115-116 °C |
Formula | C8H8N2O | Boiling Point | 284.5 °C at 760 mmHg |
Molecular Weight | 148.164 | Flash Point | 98.3 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-39 | Risk Codes |
Xi:; |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
5-Methoxy-4-azaindole;5-Methoxypyrrolo[3,2-b]pyridine; |
Article Data | 16 |
The CAS registry number of 1H-Pyrrolo[3,2-b]pyridine,5-methoxy- is 17288-40-3. The systematic name is 5-methoxy-1H-pyrrolo[3,2-b]pyridine. In addition, the molecular formula is C8H8N2O and the molecular weight is 148.16. It is a kind of irritating chemical and should be stored in a cool and dry place.
Physical properties about 1H-Pyrrolo[3,2-b]pyridine,5-methoxy- are: (1)ACD/LogP: 0.69; (2)ACD/LogD (pH 5.5): -0.84; (3)ACD/LogD (pH 7.4): 0.53; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1.35; (6)ACD/KOC (pH 5.5): 1.67; (7)ACD/KOC (pH 7.4): 38.79; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 27.05 Å2; (12)Index of Refraction: 1.647; (13)Molar Refractivity: 43.29 cm3; (14)Molar Volume: 119 cm3; (15)Polarizability: 17.16 ×10-24cm3; (16)Surface Tension: 53.1 dyne/cm; (17)Density: 1.244 g/cm3; (18)Flash Point: 98.3 °C; (19)Enthalpy of Vaporization: 50.25 kJ/mol; (20)Boiling Point: 284.5 °C at 760 mmHg; (21)Vapour Pressure: 0.00509 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: n1c(OC)ccc2c1ccn2
(2)InChI: InChI=1/C8H8N2O/c1-11-8-3-2-6-7(10-8)4-5-9-6/h2-5,9H,1H3
(3)InChIKey: WTIFEVSWZUSXQL-UHFFFAOYAX