2′-Chloro-5′-nitroacetophenone
Properties
- Molecular formula
- C8H6ClNO3
- Molar mass
- 199.59 g/mol
- Exact mass
- 199.0036 Da
- Melting point
- 62 °C
- logP
- 2.45Crippen estimate
- Polar surface area
- 60.2 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 2
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H317 May cause an allergic skin reaction25% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation50% of notifiers
- H341 Suspected of causing genetic defects50% of notifiers
Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P203, P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
23082-50-0SMILES
CC(=O)c1cc([N+](=O)[O-])ccc1ClInChIKey
PNXVQYABDFYOFY-UHFFFAOYSA-NInChI
InChI=1S/C8H6ClNO3/c1-5(11)7-4-6(10(12)13)2-3-8(7)9/h2-4H,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- Ethanone, 1-(2-chloro-5-nitrophenyl)-
- Acetophenone, 2′-chloro-5′-nitro-
- 1-(2-Chloro-5-nitrophenyl)ethanone
- 2-Chloro-5-nitroacetophenone
- 1-(2-Chloro-5-nitrophenyl)-ethan-1-one
- 1-(2-Chloro-5-nitrophenyl)ethan-1-one
Work with 2′-Chloro-5′-nitroacetophenone
Similar compounds
2-Chloro-5-nitrobenzoyl chloride25784-91-267 % similar
1-(2-Hydroxy-5-nitrophenyl)ethanone1450-76-665 % similar
2-Chloro-5-nitrobenzamide16588-15-165 % similar
2-Chloro-5-nitrobenzoic acid2516-96-365 % similar
1-(2-Fluoro-5-nitrophenyl)ethan-1-one79110-05-765 % similar
Methyl 2-chloro-5-nitrobenzoate6307-82-064 % similar
3′-Nitroacetophenone121-89-162 % similar
2-Chloro-5-nitrobenzophenone34052-37-460 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds