5'-Bromo-2'-hydroxy-3'-nitroacetophenone
Properties
- Molecular formula
- C8H6BrNO4
- Molar mass
- 260.04 g/mol
- Exact mass
- 258.9480 Da
- logP
- 2.27Crippen estimate
- Polar surface area
- 80.4 Ų
- H-bond donors / acceptors
- 1 / 4
- Rotatable bonds
- 2
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.7% 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
70978-54-0SMILES
CC(=O)C1=C(C(=CC(=C1)Br)[N+](=O)[O-])OInChIKey
CLNIBJASCGZXHH-UHFFFAOYSA-NInChI
InChI=1S/C8H6BrNO4/c1-4(11)6-2-5(9)3-7(8(6)12)10(13)14/h2-3,12H,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 5'-Bromo-2'-hydroxy-3'-nitroacetophenone
Similar compounds
2'-Hydroxy-5'-methyl-3'-nitroacetophenone66108-30-369 % similar
2-Hydroxy-5-chloro-3-nitroacetophenone84942-40-567 % similar
2′-Hydroxy-3′-nitroacetophenone28177-69-760 % similar
3',5'-Dibromo-2'-hydroxyacetophenone22362-66-960 % similar
4-Bromo-2-fluoro-6-nitrophenol320-76-356 % similar
4-Hydroxy-3-nitroacetophenone6322-56-153 % similar
1-(4-Bromo-3-nitrophenyl)ethanone18640-58-951 % similar
5-Bromo-2-nitro-benzoic acid6950-43-250 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.