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

Name
1H-PYRROLO[3,2-B]PYRIDINE-2-CARBALDEHYDE
EINECS
CAS No. 17288-52-7
Article Data6
CAS DataBase
Density 1.369 g/cm³
Solubility
Melting Point
Formula C₈H₆N₂O
Boiling Point 361.126 °C at 760 mmHg
Molecular Weight 146.148
Flash Point 175.979 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Pyrrolo[3,2-b]pyridine-2-carbaldehyde;
PSA 45.75000
LogP 1.37540

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

This chemical's CAS registry number is 17288-52-7 and it also known as Pyrrolo[3,2-b]pyridine-2-carbaldehyde. This chemical's molecular formula is C₈H₆N₂O and molecular weight is 146.146. What's more, its systematic name is called 1H-Pyrrolo[3,2-b]pyridine-2-carbaldehyde.

Physical properties about 1H-Pyrrolo[3,2-b]pyridine-2-carboxaldehyde are: (1)ACD/LogP: 1.48; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 17; (7)ACD/KOC (pH 7.4): 30; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 45.75 Å²; (12)Index of Refraction: 1.747; (13)Molar Refractivity: 43.373 cm³; (14)Molar Volume: 106.761 cm³; (15)Polarizability: 17.194×10^-24 cm³; (16)Surface Tension: 71.011 dyne/cm; (17)Density: 1.369 g/cm³; (18)Flash Point: 175.979 °C; (19)Enthalpy of Vaporization: 60.692 kJ/mol; (20)Boiling Point: 361.126 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=Cc1cc2ncccc2n1
(2) InChI: InChI=1/C8H6N2O/c11-5-6-4-8-7(10-6)2-1-3-9-8/h1-5,10H
(3) InChIKey: DQSXESUAVDEVJI-UHFFFAOYAN

Product Name

1H-PYRROLO[3,2-B]PYRIDINE-2-CARBALDEHYDE

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

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