Basic information
- CAS
383142-65-2- Standard SMILES
O=Cc1nc(-c2cccc(Br)c2)cs1- InChIKey
RMSDNZQBVXEJNI-UHFFFAOYSA-N- Molecular formula
- C10H6BrNOS
- Average molar mass
- 268.13 g/mol
- Monoisotopic mass
- 266.93535
Names & identifiers
- Preferred name
- 4-(3-Bromophenyl)-1,3-thiazole-2-carbaldehyde
- IUPAC
- 4-(3-bromophenyl)-1,3-thiazole-2-carbaldehyde
Names & synonyms
383142-65-24-(3-bromophenyl)-1,3-thiazole-2-carbaldehyde2-Thiazolecarboxaldehyde, 4-(3-bromophenyl)-4-(3-Bromophenyl)thiazole-2-carbaldehydeDTXSID101268472AKOS0122270744-(3-Bromophenyl)-2-thiazolecarboxaldehydeCS-0263222EN300-8561992Z1037606460
Database identifiers
- CAS
383142-65-2- PubChem CID
- 53404141
- DTXSID
DTXSID101268472
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 214
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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