Ethyl 4-fluoro-3-nitrobenzoate
Properties
- Molecular formula
- C9H8FNO4
- Molar mass
- 213.16 g/mol
- Exact mass
- 213.0437 Da
- Melting point
- 45.3 °C
- logP
- 1.91Crippen estimate
- Polar surface area
- 69.4 Ų
- H-bond donors / acceptors
- 0 / 4
- Rotatable bonds
- 3
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H312 Harmful in contact with skin100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled100% 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
367-80-6SMILES
CCOC(=O)c1ccc(F)c([N+](=O)[O-])c1InChIKey
YONVBKVUSUGBQR-UHFFFAOYSA-NInChI
InChI=1S/C9H8FNO4/c1-2-15-9(12)6-3-4-7(10)8(5-6)11(13)14/h3-5H,2H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
2 names
- Benzoic acid, 4-fluoro-3-nitro-, ethyl ester
- 4-Fluoro-3-nitrobenzoic acid ethyl ester
Work with Ethyl 4-fluoro-3-nitrobenzoate
Similar compounds
Ethyl 4-chloro-3-nitrobenzoate16588-16-271 % similar
Methyl 4-fluoro-3-nitrobenzoate329-59-970 % similar
4-Hydroxy-3-nitrobenzoic acid ethyl ester19013-10-670 % similar
4-Ethoxycarbonyl-2-nitrophenylboronic acid5785-70-665 % similar
Ethyl 3,4-difluorobenzoate144267-96-964 % similar
Ethyl 2-amino-6-fluoro-3-nitrobenzoate150368-37-962 % similar
Ethyl 4-nitrobenzoate99-77-461 % similar
4'-Fluoro-3'-nitroacetophenone400-93-160 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds