Ethyl 2,2-dibromo-2-fluoroacetate
Properties
- Molecular formula
- C4H5Br2FO2
- Molar mass
- 263.89 g/mol
- Exact mass
- 261.8640 Da
- logP
- 1.96Crippen estimate
- Polar surface area
- 26.3 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 2
Hazards
Danger
- H301 Toxic if swallowed37.5% of notifiers
- H302 Harmful if swallowed62.5% of notifiers
- H311 Toxic in contact with skin37.5% of notifiers
- H312 Harmful in contact with skin50% of notifiers
- H314 Causes severe skin burns and eye damage100% of notifiers
- H318 Causes serious eye damage12.5% of notifiers
- H330 Fatal if inhaled12.5% of notifiers
- H331 Toxic if inhaled12.5% of notifiers
- H335 May cause respiratory irritation12.5% of notifiers
Aggregated from 8 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P262, P264, P264+P265, P270, P271, P280, P284, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P320, P321, P330, P361+P364, P362+P364, P363, P403+P233, P405, P501
Identifiers
CAS number
565-53-7SMILES
CCOC(=O)C(F)(Br)BrInChIKey
COYRDMUQLSIAEX-UHFFFAOYSA-NInChI
InChI=1S/C4H5Br2FO2/c1-2-9-3(8)4(5,6)7/h2H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- Ethyl dibromofluoroacetate
Work with Ethyl 2,2-dibromo-2-fluoroacetate
Similar compounds
Ethyl bromodifluoroacetate667-27-666 % similar
1,4-Diethyl 2,2,3,3-tetrafluorobutanedioate377-71-961 % similar
Ethyl trifluoroacetate383-63-161 % similar
1,3-Diethyl 2,2-dibromopropanedioate631-22-161 % similar
Diethyl 2,2-difluoromalonate680-65-961 % similar
Ethyl 2-bromo-2,3,3,3-tetrafluoropropionate10186-73-959 % similar
2,2-Difluoropropionic acid ethyl ester28781-85-357 % similar
1,3-Diethyl 2-bromo-2-methylpropanedioate29263-94-357 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.