2,5-Dimethyl-1-m-tolyl-1H-pyrrole-3-carbaldehyde
Basic information
- CAS
423749-16-0- Standard SMILES
Cc1cccc(-n2c(C)cc(C=O)c2C)c1- InChIKey
FKEZLVYJTIRCEZ-UHFFFAOYSA-N- Molecular formula
- C14H15NO
- Average molar mass
- 213.27 g/mol
- Monoisotopic mass
- 213.1153641
Names & identifiers
- Preferred name
- 2,5-Dimethyl-1-m-tolyl-1H-pyrrole-3-carbaldehyde
- IUPAC
- 2,5-dimethyl-1-(3-methylphenyl)pyrrole-3-carbaldehyde
- English name
- 2,5-Dimethyl-1-m-tolyl-1H-pyrrole-3-carbaldehyde
- Molecular formula
- C14H15NO
- Molecular weight
- 213.27
Names & synonyms
423749-16-02,5-Dimethyl-1-m-tolyl-1H-pyrrole-3-carbaldehyde2,5-Dimethyl-1-(m-tolyl)-1H-pyrrole-3-carbaldehyde2,5-dimethyl-1-(3-methylphenyl)-1H-pyrrole-3-carbaldehyde2,5-dimethyl-1-(3-methylphenyl)pyrrole-3-carbaldehydeCBMicro_001106SCHEMBL12222500DTXSID20358111SMSF0010209YRA74916AKOS000113304CB02779
Show more names
1H-Pyrrole-3-carboxaldehyde, 2,5-dimethyl-1-(3-methylphenyl)-
SB62685BIM-0001256.P001CS-0219627EN300-04515G382382,5-dimethyl-1-(m-tolyl)pyrrole-3-carbaldehydeSR-01000224354SR-01000224354-1
Database identifiers
- CAS
423749-16-0- PubChem CID
- 877572
- DTXSID
DTXSID20358111
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 22 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 253
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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