2-Pyrrolidinone, 1-(2-(2-hydroxy-2-(3-methylphenyl)ethoxy)ethyl)-
Basic information
- CAS
131961-32-5- Standard SMILES
Cc1cccc(C(O)COCCN2CCCC2=O)c1- InChIKey
XEYGUVUMSVRWED-UHFFFAOYSA-N- Molecular formula
- C15H21NO3
- Average molar mass
- 263.33 g/mol
- Monoisotopic mass
- 263.15214353
Names & identifiers
- Preferred name
- 2-Pyrrolidinone, 1-(2-(2-hydroxy-2-(3-methylphenyl)ethoxy)ethyl)-
- IUPAC
- 1-[2-[2-hydroxy-2-(3-methylphenyl)ethoxy]ethyl]pyrrolidin-2-one
Names & synonyms
1-(2-(2-Hydroxy-2-(3-methylphenyl)ethoxy)ethyl)-2-pyrrolidinone131961-32-52-Pyrrolidinone, 1-(2-(2-hydroxy-2-(3-methylphenyl)ethoxy)ethyl)-RefChem:266821DTXSID509274351-{2-[2-HYDROXY-2-(3-METHYLPHENYL)ETHOXY]ETHYL}PYRROLIDIN-2-ONE
Database identifiers
- CAS
131961-32-5- PubChem CID
- 3076574
- DTXSID
DTXSID50927435
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 295
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…