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CAS No.: | 357263-41-3 |
---|---|
Name: | 7-CHLORO-1H-PYRROLO[2,3-C]PYRIDINE |
Article Data: | 27 |
Molecular Structure: | |
Formula: | C7H5ClN2 |
Molecular Weight: | 152.583 |
Synonyms: | 7-Chloro-6-azaindole;7-Chloro-1H-pyrrolo[2,3-c]pyridine;7-chloro-1H-pyrrolo[2,3-c]pyridine;1H-Pyrrolo[2,3-c]pyridine, 7-chloro-;7-Chloro-1H-pyrrolo[2,3-c]pyridine; |
Density: | 1.425 g/cm3 |
Melting Point: | 123-124 °C |
Boiling Point: | 335.794 °C at 760 mmHg |
Flash Point: | 187.228 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37/39 |
PSA: | 28.68000 |
LogP: | 2.21630 |
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The 7-Chloro-1H-pyrrolo[2,3-c]pyridine, with the CAS registry number 357263-41-3, is also called 7-Chloro-6-azaindole. It belongs to the following procuct categories: Halides; Fused Ring Systems; Indole series. And the molecular formula of this chemical is C7H5ClN2. What's more, it should be protected from oxidates.
The physical properties of 7-Chloro-1H-pyrrolo[2,3-c]pyridine are as followings: (1)ACD/LogP: 2.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 6; (6)ACD/BCF (pH 7.4): 14; (7)ACD/KOC (pH 5.5): 93; (8)ACD/KOC (pH 7.4): 232; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 28.68 Å2; (13)Index of Refraction: 1.703; (14)Molar Refractivity: 41.515 cm3; (15)Molar Volume: 107.046 cm3; (16)Polarizability: 16.458×10-24cm3; (17)Surface Tension: 62.289 dyne/cm; (18)Density: 1.425 g/cm3; (19)Flash Point: 187.228 °C; (20)Enthalpy of Vaporization: 55.594 kJ/mol; (21)Boiling Point: 335.794 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1nccc2c1ncc2
(2)InChI: InChI=1/C7H5ClN2/c8-7-6-5(1-3-9-6)2-4-10-7/h1-4,9H
(3)InChIKey: HOHKYYCVFMEBGG-UHFFFAOYAQ