2,5-dimethyl-1-(naphthalen-2-yl)-1H-pyrrole-3-carbaldehyde
Basic information
- CAS
347332-17-6- Standard SMILES
Cc1cc(C=O)c(C)n1-c1ccc2ccccc2c1- InChIKey
RQNRDDLLJCHDFK-UHFFFAOYSA-N- Molecular formula
- C17H15NO
- Average molar mass
- 249.31 g/mol
- Monoisotopic mass
- 249.1153641
Names & identifiers
- Preferred name
- 2,5-dimethyl-1-(naphthalen-2-yl)-1H-pyrrole-3-carbaldehyde
- IUPAC
- 2,5-dimethyl-1-naphthalen-2-ylpyrrole-3-carbaldehyde
- English name
- CHEMBRDG-BB 6097029
- Molecular formula
- C17H15NO
- Molecular weight
- 249.31
Names & synonyms
347332-17-62,5-dimethyl-1-(naphthalen-2-yl)-1H-pyrrole-3-carbaldehyde2,5-DIMETHYL-1-(2-NAPHTHYL)-1H-PYRROLE-3-CARBALDEHYDEMFCD022156652,5-dimethyl-1-naphthalen-2-ylpyrrole-3-carbaldehyde2,5-dimethyl-1-(2-naphthyl)pyrrole-3-carbaldehydeST51017896CBMicro_013929DTXSID00358179SMSF0013844BBL023300STL285283
Show more names
CHEMBRDG-BB 60970291H-Pyrrole-3-carboxaldehyde, 2,5-dimethyl-1-(2-naphthalenyl)-2,5-dimethyl-1-(2-naphthyl)-1H-pyrrole-3-carbaldehyde(SALTDATA: FREE)
AKOS000113717CB07333SB62760VS-07389BIM-0013825.P001DB-192057CS-0117968F314806
Database identifiers
- CAS
347332-17-6- PubChem CID
- 879568
- DTXSID
DTXSID00358179
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 22 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 329
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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