3-Bromo-5H-pyrrolo[3,4-b]pyridin-7(6H)-one
Properties
- Molecular formula
- C7H5BrN2O
- Molar mass
- 213.03 g/mol
- Exact mass
- 211.9585 Da
- logP
- 1.09Crippen estimate
- Polar surface area
- 42.0 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 0
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
1346809-61-7SMILES
C1C2=C(C(=O)N1)N=CC(=C2)BrInChIKey
MIVZJHZGDCIYBT-UHFFFAOYSA-NInChI
InChI=1S/C7H5BrN2O/c8-5-1-4-2-10-7(11)6(4)9-3-5/h1,3H,2H2,(H,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 7H-Pyrrolo[3,4-B]pyridin-7-one, 3-bromo-5,6-dihydro-
Work with 3-Bromo-5H-pyrrolo[3,4-b]pyridin-7(6H)-one
Similar compounds
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6-Bromo-2,3-dihydro-1H-isoindol-1-one675109-26-950 % similar
6-Bromo-3,4-dihydro-2H-isoquinolin-1-one147497-32-344 % similar
3-Amino-5-bromopyridine-2-carboxamide669066-89-141 % similar
5-Bromo-3-fluoropicolinic acid669066-91-540 % similar
3-Amino-5-bromopyridine-2-carboxylic acid870997-85-640 % similar
5-Bromo-2-carboxy-3-methylpyridine886365-43-140 % similar
7-Bromo-3,4-dihydroisoquinolin-1(2H)-one891782-60-840 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.