Basic information
- CAS
43148-98-7- Standard SMILES
C#CCOCC1CN(c2ccc(CC(=O)O)cc2)C(=O)O1- InChIKey
SBQMWXMHHZYIMI-UHFFFAOYSA-N- Molecular formula
- C15H15NO5
- Average molar mass
- 289.28 g/mol
- Monoisotopic mass
- 289.09502258
Names & identifiers
- Preferred name
- Acetic acid, 4-(2-oxo-5-(2-propynyloxymethyl-3-oxazolidinyl))phenyl-
- IUPAC
- 2-[4-[2-oxo-5-(prop-2-ynoxymethyl)-1,3-oxazolidin-3-yl]phenyl]acetic acid
- English name
- 4-[2-Oxo-5-(2-propynyloxymethyl)oxazolidin-3-yl]phenylacetic acid
- Molecular formula
- C15H15NO5
- Molecular weight
- 289.28
Names & synonyms
43148-98-7BRN 05669652-Oxazolidinone, 3-(4-carboxymethylphenyl)-5-(2-propynyloxymethyl)-ACETIC ACID, 4-(2-OXO-5-(2-PROPYNYLOXYMETHYL-3-OXAZOLIDINYL))PHENYL-RefChem:3165322-(4-(2-Oxo-5-((prop-2-yn-1-yloxy)methyl)oxazolidin-3-yl)phenyl)acetic acidDTXSID50962927[4-(2-Oxo-5-{[(prop-2-yn-1-yl)oxy]methyl}-1,3-oxazolidin-3-yl)phenyl]acetic acid4-[2-Oxo-5-(2-propynyloxymethyl)oxazolidin-3-yl]phenylacetic acidBenzeneacetic acid, 4-[2-oxo-5-[(2-propyn-1-yloxy)methyl]-3-oxazolidinyl]-
Database identifiers
- CAS
43148-98-7- PubChem CID
- 39392
- DTXSID
DTXSID50962927- Nikkaji
- J86.262B
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 76.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 433
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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