2-(4-Methylphenyl)-1H-imidazole
Basic information
- CAS
37122-50-2- Standard SMILES
Cc1ccc(-c2ncc[nH]2)cc1- InChIKey
QHNDFWPCDITBSG-UHFFFAOYSA-N- Molecular formula
- C10H10N2
- Average molar mass
- 158.2 g/mol
- Monoisotopic mass
- 158.08439833
Names & identifiers
- Preferred name
- 2-(4-Methylphenyl)-1H-imidazole
- IUPAC
- 2-(4-methylphenyl)-1H-imidazole
- English name
- 2-(4-Methylphenyl)-1H-imidazole
- Molecular formula
- C10H10N2
- Molecular weight
- 158.2
Names & synonyms
37122-50-22-(p-tolyl)-1H-imidazole2-(4-Methylphenyl)-1H-imidazole2-(4-Methylphenyl)imidazole2-p-TolylimidazoleMFCD12818506CHEMBL2754031H-Imidazole, 2-(4-methylphenyl)-p-tolylimidazole2-p-tolyl imidazoleSCHEMBL674010SCHEMBL2464174
Show more names
1H-Imidazole, 2-(4-methylphenyl)
SCHEMBL5111459SCHEMBL28536156DTXSID80344035AC6024BDBM504731512-(4-Methylphenyl)-1H-imidazole #AKOS010225816SY057695
Database identifiers
- CAS
37122-50-2- PubChem CID
- 594045
- DTXSID
DTXSID80344035- ChEMBL
CHEMBL275403- Nikkaji
- J109.523D
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 139
Physicochemical properties
- Melting point
- 219 · 219-221 °C
- Boiling point
- 345.1 · 345.1±21.0 °C(Predicted)
- Density
- 1.109 · 1.109±0.06 g/cm3(Predicted)
- pka
- 13.3 · 13.30±0.10(Predicted)
- 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
4 records
Compound notes
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