Basic information
- CAS
97690-10-3- Standard SMILES
Cc1ccc(C)n1-c1ccccc1CO- InChIKey
FWGFXLVQDMQFBT-UHFFFAOYSA-N- Molecular formula
- C13H15NO
- Average molar mass
- 201.26 g/mol
- Monoisotopic mass
- 201.1153641
Names & identifiers
- Preferred name
- Benzenemethanol, 2-(2,5-dimethyl-1H-pyrrol-1-yl)-
- IUPAC
- [2-(2,5-dimethylpyrrol-1-yl)phenyl]methanol
Names & synonyms
97690-10-3Benzenemethanol, 2-(2,5-dimethyl-1H-pyrrol-1-yl)-DTXSID50345978RefChem:324896DTXCID20297051[2-(2,5-Dimethyl-1H-pyrrol-1-yl)phenyl]methanol[2-(2,5-dimethylpyrrol-1-yl)phenyl]methanol(2-(2,5-Dimethyl-1H-pyrrol-1-yl)phenyl)methanolFWGFXLVQDMQFBT-UHFFFAOYSA-NSTK955925AKOS003791085ST102623
Show more names
ST45057246[2-(2,5-dimethylpyrrolyl)phenyl]methan-1-ol2,5-Dimethyl-1-[(2-hydroxymethyl)phenyl]pyrroleAK-968/41169757[2-(2,5-Dimethyl-1H-pyrrol-1-yl)phenyl]methanol #
Database identifiers
- CAS
97690-10-3- PubChem CID
- 608481
- DTXSID
DTXSID50345978- Nikkaji
- J610.236K
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 25.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 197
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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