3-Bromo-5-(trifluoromethyl)benzaldehyde
Properties
- Molecular formula
- C8H4BrF3O
- Molar mass
- 253.02 g/mol
- Exact mass
- 251.9398 Da
- logP
- 3.28Crippen estimate
- Polar surface area
- 17.1 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed11.1% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled22.2% of notifiers
- H335 May cause respiratory irritation88.9% of notifiers
Aggregated from 9 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
477535-41-4SMILES
C1=C(C=C(C=C1C(F)(F)F)Br)C=OInChIKey
PCRLZGCXLNNMFL-UHFFFAOYSA-NInChI
InChI=1S/C8H4BrF3O/c9-7-2-5(4-13)1-6(3-7)8(10,11)12/h1-4HWeigh it out
Type any one amount. The others follow from the molar mass.
Work with 3-Bromo-5-(trifluoromethyl)benzaldehyde
Similar compounds
3,5-Bis(trifluoromethyl)benzaldehyde401-95-671 % similar
5-Bromoisophthalaldehyde120173-41-361 % similar
1-Bromo-3,5-bis(trifluoromethyl)benzene328-70-161 % similar
1,3-Dibromo-5-(trifluoromethyl)benzene401-84-361 % similar
3,5-Dibromobenzaldehyde56990-02-461 % similar
3-Fluoro-5-(trifluoromethyl)benzaldehyde188815-30-761 % similar
3-Bromo-5-fluorobenzaldehyde188813-02-755 % similar
3-Bromo-5-(trifluoromethoxy)benzaldehyde886498-07-354 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.