3-(Bromomethyl)benzaldehyde
Properties
- Molecular formula
- C8H7BrO
- Molar mass
- 199.05 g/mol
- Exact mass
- 197.9680 Da
- logP
- 2.39Crippen estimate
- Polar surface area
- 17.1 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 2
Hazards
Danger
- H302 Harmful if swallowed100% of notifiers
- H312 Harmful in contact with skin50% of notifiers
- H314 Causes severe skin burns and eye damage100% of notifiers
- H318 Causes serious eye damage25% of notifiers
- H332 Harmful if inhaled100% of notifiers
- H335 May cause respiratory irritation50% of notifiers
Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P362+P364, P363, P403+P233, P405, P501
Identifiers
CAS number
82072-23-9SMILES
C1=CC(=CC(=C1)C=O)CBrInChIKey
OEPGAYXSRGROSQ-UHFFFAOYSA-NInChI
InChI=1S/C8H7BrO/c9-5-7-2-1-3-8(4-7)6-10/h1-4,6H,5H2Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 3-(Bromomethyl)benzaldehyde
Similar compounds
1,3-Bis(bromomethyl)benzene626-15-358 % similar
Isophthalaldehyde626-19-758 % similar
3-Bromobenzaldehyde3132-99-852 % similar
3-Benzyloxybenzaldehyde1700-37-449 % similar
3-Fluorobenzyl bromide456-41-748 % similar
3-Fluorobenzaldehyde456-48-448 % similar
3-Chlorobenzaldehyde587-04-248 % similar
3-Chlorobenzyl bromide766-80-348 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.