Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
4-Chloro-2-iodo-1H-pyrrolo[2,3-b]pyridine |
EINECS | N/A |
CAS No. | 940948-29-8 | Density | 2.156 g/cm3 |
PSA | 28.68000 | LogP | 2.82090 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H4ClIN2 | Boiling Point | 374 °C at 760 mmHg |
Molecular Weight | 278.48 | Flash Point | 180 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-39 | Risk Codes | 41 |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
4-Chlor-2-iod-1H-pyrrolo[2,3-b]pyridin;4-Chloro-2-iodo-1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[2,3-b]pyridine, 4-chloro-2-iodo-; |
Article Data | 4 |
The 4-Chloro-2-iodo-1H-pyrrolo[2,3-b]pyridine, with CAS registry number 940948-29-8, has the systematic name of 4-chloro-2-iodo-1H-pyrrolo[2,3-b]pyridine. Besides this, it is also called 1H-pyrrolo[2,3-b]pyridine, 4-chloro-2-iodo-. And the chemical formula of this chemical is C7H4ClIN2.
Physical properties of 4-Chloro-2-iodo-1H-pyrrolo[2,3-b]pyridine: (1)ACD/LogP: 3.55; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.55; (4)ACD/LogD (pH 7.4): 3.55; (5)#H bond acceptors: 2; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 28.68 Å2; (9)Index of Refraction: 1.784; (10)Molar Refractivity: 54.42 cm3; (11)Molar Volume: 129.1 cm3; (12)Polarizability: 21.57×10-24cm3; (13)Surface Tension: 72.1 dyne/cm; (14)Enthalpy of Vaporization: 59.7 kJ/mol; (15)Vapour Pressure: 1.85E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cnc2c(c1Cl)cc([nH]2)I
(2)InChI: InChI=1/C7H4ClIN2/c8-5-1-2-10-7-4(5)3-6(9)11-7/h1-3H,(H,10,11)
(3)InChIKey: PNYLOXIZBXVOPD-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C7H4ClIN2/c8-5-1-2-10-7-4(5)3-6(9)11-7/h1-3H,(H,10,11)
(5)Std. InChIKey: PNYLOXIZBXVOPD-UHFFFAOYSA-N