1H-Pyrrolo[2,3-b]pyridine-3-aceticacid supplier

Name
1H-pyrrolo(2,3-b)pyridine-3-acetic acid
EINECS
CAS No. 1912-42-1
Density 1.437 g/cm³
Solubility
Melting Point 214.5-215.0 °C (decomp)
Formula C₉H₈N₂O₂
Boiling Point 436.9 °C at 760 mmHg
Molecular Weight 176.175
Flash Point 218.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (1H-Pyrrolo[2,3-b]pyridin-3-yl)aceticacid;7-Azaindole-3-acetic acid;
PSA 65.98000
LogP 1.58010

1H-Pyrrolo[2,3-b]pyridine-3-aceticacid Specification

The 1H-Pyrrolo[2, 3-b]pyridine-3-aceticacid, with the CAS registry number 1912-42-1, is also known as 1H-pyrrolo[2, 3-b]pyridin-3-ylacetic acid. This chemical's molecular formula is C₉H₈N₂O₂ and molecular weight is 176.172. What's more, its IUPAC name is 2-(1H-pyrrolo[2, 3-b]pyridin-3-yl)acetic acid.

Physical properties about 1H-Pyrrolo[2, 3-b]pyridine-3-aceticacid are: (1)ACD/LogP: 1.11; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 65.98 Å²; (7)Index of Refraction: 1.707; (8)Molar Refractivity: 47.73 cm³; (9)Molar Volume: 122.5 cm³; (10)Polarizability: 18.92×10^-24 cm³; (11)Surface Tension: 77.2 dyne/cm; (12)Density: 1.437 g/cm³; (13)Flash Point: 218.1 °C; (14)Enthalpy of Vaporization: 73.09 kJ/mol; (15)Boiling Point: 436.9 °C at 760 mmHg; (16)Vapour Pressure: 2.08E-08 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OC(=O)Cc2cnc1ncccc12
(2) InChI: InChI=1/C9H8N2O2/c12-8(13)4-6-5-11-9-7(6)2-1-3-10-9/h1-3,5H,4H2,(H,10,11)(H,12,13)
(3) InChIKey: NQHGQOVKJGGLKE-UHFFFAOYAE

Product Name

1H-pyrrolo(2,3-b)pyridine-3-acetic acid

1H-Pyrrolo[2,3-b]pyridine-3-aceticacid Specification

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