2-Cyano-5-fluorobenzyl bromide
Properties
- Molecular formula
- C8H5BrFN
- Molar mass
- 214.04 g/mol
- Exact mass
- 212.9589 Da
- logP
- 2.59Crippen estimate
- Polar surface area
- 23.8 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H290 May be corrosive to metals25% of notifiers
- H302 Harmful if swallowed100% of notifiers
- H312 Harmful in contact with skin75% of notifiers
- H314 Causes severe skin burns and eye damage50% of notifiers
- H315 Causes skin irritation50% of notifiers
- H318 Causes serious eye damage25% of notifiers
- H319 Causes serious eye irritation50% of notifiers
- H332 Harmful if inhaled100% of notifiers
- H335 May cause respiratory irritation75% of notifiers
Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P234, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P390, P403+P233, P405, P406, P501
Identifiers
CAS number
421552-12-7SMILES
C1=CC(=C(C=C1F)CBr)C#NInChIKey
CHCAGFNTASDQFX-UHFFFAOYSA-NInChI
InChI=1S/C8H5BrFN/c9-4-7-3-8(10)2-1-6(7)5-11/h1-3H,4H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 2-(Bromomethyl)-4-fluorobenzonitrile
Work with 2-Cyano-5-fluorobenzyl bromide
Similar compounds
4-Fluoro-1,2-benzenedicarbonitrile65610-14-258 % similar
2-Cyanobenzyl bromide22115-41-956 % similar
2-Bromo-4-fluorobenzonitrile36282-26-556 % similar
2,4-Difluorobenzonitrile3939-09-155 % similar
2,5-Difluorobenzyl bromide85117-99-355 % similar
1-Bromo-2-(bromomethyl)-4-fluorobenzene112399-50-553 % similar
2-Bromo-1-(bromomethyl)-4-fluorobenzene61150-57-053 % similar
4-Fluoro-2-methylbenzonitrile147754-12-951 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds