4-Bromoindole
Properties
- Molecular formula
- C8H6BrN
- Molar mass
- 196.05 g/mol
- Exact mass
- 194.9684 Da
- Melting point
- 15 °C
- Boiling point
- 96 °C (at 1 Torr)
- logP
- 2.93Crippen estimate
- Polar surface area
- 15.8 Ų
- H-bond donors / acceptors
- 1 / 0
- Rotatable bonds
- 0
Hazards
Warning
- H315 Causes skin irritation95.5% of notifiers
- H319 Causes serious eye irritation95.5% of notifiers
- H335 May cause respiratory irritation93.2% of notifiers
Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
52488-36-5SMILES
Brc1cccc2[nH]ccc12InChIKey
GRJZJFUBQYULKL-UHFFFAOYSA-NInChI
InChI=1S/C8H6BrN/c9-7-2-1-3-8-6(7)4-5-10-8/h1-5,10HWeigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- 1H-Indole, 4-bromo-
- Indole, 4-bromo-
- 4-Bromo-1H-indole
Work with 4-Bromoindole
Similar compounds
4-Chloroindole25235-85-256 % similar
4-Bromo-1H-pyrrolo(2,3-c)pyridine69872-17-955 % similar
4-Methylindole16096-32-554 % similar
1H-Indol-4-ol2380-94-154 % similar
4-Fluoroindole387-43-954 % similar
4-Aminoindole5192-23-454 % similar
Indole-4-methanol1074-85-748 % similar
Indole-4-carboxaldehyde1074-86-848 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.