7-Bromoisatin
Properties
- Molecular formula
- C8H4BrNO2
- Molar mass
- 226.03 g/mol
- Exact mass
- 224.9425 Da
- Melting point
- 203–204 °C
- logP
- 1.58Crippen estimate
- Polar surface area
- 46.2 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 0
Hazards
Danger
- H302 Harmful if swallowed87.2% of notifiers
- H315 Causes skin irritation100% of notifiers
- H318 Causes serious eye damage85.1% of notifiers
- H319 Causes serious eye irritation14.9% of notifiers
- H335 May cause respiratory irritation97.9% of notifiers
Aggregated from 47 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, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
20780-74-9SMILES
O=C1Nc2c(Br)cccc2C1=OInChIKey
OCVKSIWBTJCXPV-UHFFFAOYSA-NInChI
InChI=1S/C8H4BrNO2/c9-5-3-1-2-4-6(5)10-8(12)7(4)11/h1-3H,(H,10,11,12)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- 1H-Indole-2,3-dione, 7-bromo-
- Indole-2,3-dione, 7-bromo-
- Isatin, 7-bromo-
- 7-Bromo-1H-indole-2,3-dione
- 7-Bromoindoline-2,3-dione
- 7-Bromoindole-2,3-dione
- 7-Bromo-2,3-dioxoindoline
Work with 7-Bromoisatin
Similar compounds
7-Chloroisatin7477-63-666 % similar
7-Methylisatin1127-59-962 % similar
7-Fluoroisatin317-20-462 % similar
2,3-Dioxoindoline-7-carboxylic acid25128-35-260 % similar
7-Trifluoromethylisatin391-12-857 % similar
Isatin91-56-553 % similar
4-Bromo-7-methylisatin874375-17-449 % similar
5,7-Dichloroisatin6374-92-144 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.