structure of 3,4-dinitro-1H-pyrrolo[2,3-b]pyridine

3,4-dinitro-1H-pyrrolo[2,3-b]pyridine

CAS No.: 1000340-41-9
M. Wt: 208.131
M. Fa: C7H4N4O4
InChI Key: FIVUFQCXDQBUMJ-UHFFFAOYSA-N

Names and Identifiers of 3,4-dinitro-1H-pyrrolo[2,3-b]pyridine

CAS Number

1000340-41-9

IUPAC Name

3,4-dinitro-1H-pyrrolo[2,3-b]pyridine

InChI

InChI=1S/C7H4N4O4/c12-10(13)4-1-2-8-7-6(4)5(3-9-7)11(14)15/h1-3H,(H,8,9)

InChIKey

FIVUFQCXDQBUMJ-UHFFFAOYSA-N

Canonical SMILES

C1=CN=C2C(=C1[N+](=O)[O-])C(=CN2)[N+](=O)[O-]

Physical and chemical properties of 3,4-dinitro-1H-pyrrolo[2,3-b]pyridine

Boiling Point

490.9±40.0 °C at 760 mmHg

Density

1.8±0.1 g/cm3

Exact Mass

208.023254

Flash Point

250.7±27.3 °C

Index of Refraction

1.777

LogP

1.18

Molecular Formula

C7H4N4O4

Molecular Weight

208.131

PSA

120.32000

Vapour Pressure

0.0±1.2 mmHg at 25°C