Basic information
- CAS
23598-54-1- Standard SMILES
C#CCOCC1CN(c2ccccc2)C(=O)O1- InChIKey
RXVDTRQMYILFDO-UHFFFAOYSA-N- Molecular formula
- C13H13NO3
- Average molar mass
- 231.25 g/mol
- Monoisotopic mass
- 231.08954328
Names & identifiers
- Preferred name
- 2-Oxazolidinone, 3-phenyl-5-(2-propynyloxymethyl)-
- IUPAC
- 3-phenyl-5-(prop-2-ynoxymethyl)-1,3-oxazolidin-2-one
- English name
- 3-Phenyl-5-[(2-propynyloxy)methyl]-2-oxazolidinone
- Molecular formula
- C13H13NO3
- Molecular weight
- 231.25
Names & synonyms
23598-54-12-Oxazolidinone, 3-phenyl-5-(2-propynyloxymethyl)-RefChem:10639913-Phenyl-5-(2-propynyloxymethyl)-2-oxazolidinoneNSC1542952-Oxazolidinone, 3-phenyl-5-[(2-propynyloxy)methyl]-MLS003106399NSC 154295BRN 05353982-Oxazolidinone der.3-Phenyl-5-[(2-propynyloxy)methyl]-2-oxazolidinoneCHEMBL1900389
Show more names
2-Oxazolidinone, 3-phenyl-5-[(2-propyn-1-yloxy)methyl]-
DTXSID901384806NSC-154295SMR0018213053-phenyl-5-(prop-2-ynoxymethyl)oxazolidin-2-one
Database identifiers
- CAS
23598-54-1- PubChem CID
- 73582
- DTXSID
DTXSID901384806- ChEMBL
CHEMBL1900389- Nikkaji
- J42.661J
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 314
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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