p-Toluidine, 2-bromo-N-methyl-alpha-inden-1-ylidene-
Basic information
- CAS
28164-41-2- Standard SMILES
CNc1ccc(/C=C2/C=Cc3ccccc32)cc1Br- InChIKey
SJZUDCRSPDTUAH-UVTDQMKNSA-N- Molecular formula
- C17H14BrN
- Average molar mass
- 312.2 g/mol
- Monoisotopic mass
- 311.03096
Names & identifiers
- Preferred name
- p-Toluidine, 2-bromo-N-methyl-alpha-inden-1-ylidene-
- IUPAC
- 2-bromo-4-[(Z)-inden-1-ylidenemethyl]-N-methylaniline
Names & synonyms
p-Toluidine, 2-bromo-N-methyl-alpha-inden-1-ylidene-28164-41-2RefChem:10942411-(3-Bromo-4-(methylamino)benzylidene)indeneNSC 114858Indene, 1-(3-bromo-4-(methylamino)benzylidene)-
Database identifiers
- CAS
28164-41-2- PubChem CID
- 6436788
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 373
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…