4-Bromo-1H-pyrrole-2-carbaldehyde
Properties
- Molecular formula
- C5H4BrNO
- Molar mass
- 174.00 g/mol
- Exact mass
- 172.9476 Da
- logP
- 1.59Crippen estimate
- Polar surface area
- 32.9 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed66.7% of notifiers
- H312 Harmful in contact with skin33.3% of notifiers
- H315 Causes skin irritation66.7% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled33.3% of notifiers
- H335 May cause respiratory irritation66.7% of notifiers
Aggregated from 3 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
931-33-9SMILES
C1=C(NC=C1Br)C=OInChIKey
RFQYNGQAZZSGFM-UHFFFAOYSA-NInChI
InChI=1S/C5H4BrNO/c6-4-1-5(3-8)7-2-4/h1-3,7HWeigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 4-Bromopyrole-2-carboxaldehyde
Work with 4-Bromo-1H-pyrrole-2-carbaldehyde
Similar compounds
5-Bromoisophthalaldehyde120173-41-343 % similar
3,5-Dibromobenzaldehyde56990-02-443 % similar
6-Bromoindole-3-carbaldehyde17826-04-942 % similar
5-Bromoindole-3-carboxaldehyde877-03-242 % similar
5-Bromo-3-fluoro-1,2-dihydropyridin-2-one156772-63-339 % similar
5-Bromopyridine-2,3-diol34206-49-039 % similar
5-Bromo-3-iodopyridin-2-ol381233-75-639 % similar
5-Bromo-3-chloro-2-hydroxypyridine58236-70-739 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.