Product Name

  • Name

    1H-Pyrrolo[3,2-b]pyridine-3-carboxylic acid

  • EINECS
  • CAS No. 860496-20-4
  • Density 1.507g/cm3
  • Solubility
  • Melting Point
  • Formula C8H6N2O2
  • Boiling Point 446.822 °C at 760 mmHg
  • Molecular Weight 162.1454
  • Flash Point 224.03 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 860496-20-4 (1H-Pyrrolo[3,2-b]pyridine-3-carboxylic acid)
  • Hazard Symbols
  • Synonyms 1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid;4-Azaindole3-carboxylicacid;1H-pyrrolo[3,2-b]pyridine-3-carbo×ylic acid;1. 1H-Pyrrolo[3,2-b]pyridine-3-carboxylic acid
  • PSA 65.98000
  • LogP 1.26110

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

The 1H-Pyrrolo[3,2-b]pyridine-3-carboxylicacid, with CAS registry number 860496-20-4, has the systematic name of 1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid. Besides this, it is also called 4-Azaindole3-carboxylicacid. And the chemical formula of this chemical is C8H6N2O2.

Physical properties of 1H-Pyrrolo[3,2-b]pyridine-3-carboxylicacid: (1)ACD/LogP: 1.81; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 65.98 Å2; (11)Index of Refraction: 1.743; (12)Molar Refractivity: 43.55 cm3; (13)Molar Volume: 107.625 cm3; (14)Polarizability: 17.265×10-24cm3; (15)Surface Tension: 85.206 dyne/cm; (16)Density: 1.507 g/cm3; (17)Flash Point: 224.03 °C; (18)Enthalpy of Vaporization: 74.303 kJ/mol; (19)Boiling Point: 446.822 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)c2cnc1cccnc12
(2)InChI: InChI=1/C8H6N2O2/c11-8(12)5-4-10-6-2-1-3-9-7(5)6/h1-4,10H,(H,11,12)
(3)InChIKey: VAQUJLYRUQNSEV-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C8H6N2O2/c11-8(12)5-4-10-6-2-1-3-9-7(5)6/h1-4,10H,(H,11,12)
(5)Std. InChIKey: VAQUJLYRUQNSEV-UHFFFAOYSA-N

Related Products

Hot Products

Post buying leads

About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia

Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog

©2008 LookChem.com,License: ICP

NO.:Zhejiang16009103

complaints:service@lookchem.com Desktop View