2,2-Bis(4-bromoanilino)-1-(2-thienyl)ethanone
Basic information
- CAS
303095-06-9- Standard SMILES
O=C(c1cccs1)C(Nc1ccc(Br)cc1)Nc1ccc(Br)cc1- InChIKey
NAMFNVCZKSLKNX-UHFFFAOYSA-N- Molecular formula
- C18H14Br2N2OS
- Average molar mass
- 466.2 g/mol
- Monoisotopic mass
- 463.91936
Names & identifiers
- Preferred name
- 2,2-Bis(4-bromoanilino)-1-(2-thienyl)ethanone
- IUPAC
- 2,2-bis(4-bromoanilino)-1-thiophen-2-ylethanone
Names & synonyms
2,2-bis(4-bromoanilino)-1-(2-thienyl)ethanoneRefChem:440833303095-06-9683-988-1AKOS003632602
Database identifiers
- CAS
303095-06-9- PubChem CID
- 4383583
- EC Number
- 683-988-1
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 69.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 386
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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