1-(2-Methylphenyl)-1H-indole
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Basic information
- CAS
210162-61-1- Standard SMILES
Cc1ccccc1-n1ccc2ccccc21- InChIKey
BJNMTUGUPXMLLO-UHFFFAOYSA-N- Molecular formula
- C15H13N
- Average molar mass
- 207.27 g/mol
- Monoisotopic mass
- 207.10479942
Names & identifiers
- Preferred name
- 1-(2-Methylphenyl)-1H-indole
- IUPAC
- 1-(2-methylphenyl)indole
- English name
- 1H-Indole, 1-(2-Methylphenyl)-
- Molecular formula
- C15H13N
- Molecular weight
- 207.27
Names & synonyms
1-(2-METHYLPHENYL)-1H-INDOLE210162-61-12,3-MethylphenylindolSCHEMBL5604900SCHEMBL16720395SCHEMBL29896751BJNMTUGUPXMLLO-UHFFFAOYSA-NHS-51271-o-Tolyl-1H-indole1H-Indole, 1-(2-Methylphenyl)-
Database identifiers
- CAS
210162-61-1- PubChem CID
- 9834286
- Nikkaji
- J963.119D
Properties
Computed structural propertiesFilling in
- XLogP
- 4
- Topological polar surface area
- 4.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 238
Physicochemical properties
- Melting point
- 201 · 201-203 °C
- Boiling point
- 347 · 347.0±25.0 °C(Predicted)
- Density
- 1.04 · 1.04±0.1 g/cm3(Predicted)
Related reactions
3 records
Compound notes
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