5-Bromo-1,3-dihydro-2H-pyrrolo[3,2-B]pyridin-2-one

5-BroMo-4-aza-2-oxindole · 5-Bromo-4-azaindol-2(3H)-one · 5-BroMo-1,3-dihydro-2H-py... · 5-Bromo-1H-pyrrolo[3,2-b]pyridin-2(3H) · 5-Bromo-1H,3H-pyrrolo[3,2-b]pyridin-2-one · 5-BroMo-1H-pyrrolo[3,2-b]pyridin-2(3H)-one · 5-bromo-1H,2H,3H-pyrrolo[3,2-b]pyridin-2-one · 5-Bromo-1,3-dihydropyrrolo[3,2-b]pyridin-2-one

https://huagongshe.com/en/chemical/21018564

5-Bromo-1,3-dihydro-2H-pyrrolo[3,2-B]pyridin-2-one molecular structure

Identifiers & Physical Properties

CAS No.	887571-01-9
Molecular formula	C7H5BrN2O
Average molar mass	213.03 g/mol
Monoisotopic mass	211.95853 g/mol
SMILES	O=C1Cc2nc(Br)ccc2N1
InChIKey	ZGMSNALDPDFDPD-UHFFFAOYSA-N
PubChem CID	21018564
DTXSID	DTXSID10610215

Chemical & Physical Properties

XLogP	0.8
Topological polar surface area	42
Hydrogen bond donors	1
Hydrogen bond acceptors	2
Rotatable bonds	0
Heavy atoms	11
Formal charge	0
Complexity	185
Boiling point	389.6±42.0 °C(Predicted)
Density	1.768±0.06 g/cm3(Predicted)
Storage conditions	2-8°C
pKa (acidity coefficient)	11.91±0.20(Predicted)
Appearance	Light yellow to brown Solid
GHS pictogram	GHS07
Signal word	Warning
GHS hazard statements	H302-H315-H319-H335
GHS precautionary statements	P261-P305+P351+P338

Safety & Regulations

Signal word	Warning
GHS pictogram	GHS07
GHS hazard statements	H302-H315-H319-H335
GHS precautionary statements	P261-P305+P351+P338