2-Oxazolidinone, 3-(p-nitrophenyl)-5-(2-propynyloxymethyl)-
Basic information
- CAS
23598-64-3- Standard SMILES
C#CCOCC1CN(c2ccc([N+](=O)[O-])cc2)C(=O)O1- InChIKey
UNPKQAWIAWFGBH-UHFFFAOYSA-N- Molecular formula
- C13H12N2O5
- Average molar mass
- 276.24 g/mol
- Monoisotopic mass
- 276.07462149
Names & identifiers
- Preferred name
- 2-Oxazolidinone, 3-(p-nitrophenyl)-5-(2-propynyloxymethyl)-
- IUPAC
- 3-(4-nitrophenyl)-5-(prop-2-ynoxymethyl)-1,3-oxazolidin-2-one
- English name
- 3-(4-Nitrophenyl)-5-[(2-propynyloxy)methyl]-2-oxazolidinone
- Molecular formula
- C13H12N2O5
- Molecular weight
- 276.24
Names & synonyms
23598-64-3BRN 05642833-(p-Nitrophenyl)-5-(2-propynyloxymethyl)-2-oxazolidinone2-Oxazolidinone, 3-(p-nitrophenyl)-5-(2-propynyloxymethyl)-RefChem:264671DTXSID209464113-(4-Nitrophenyl)-5-[(2-propynyloxy)methyl]-2-oxazolidinone3-(4-Nitrophenyl)-5-{[(prop-2-yn-1-yl)oxy]methyl}-1,3-oxazolidin-2-one3-(4-nitro-phenyl)-5-prop-2-ynyloxymethyl-oxazolidin-2-one2-Oxazolidinone, 3-(4-nitrophenyl)-5-[(2-propyn-1-yloxy)methyl]-
Database identifiers
- CAS
23598-64-3- PubChem CID
- 211835
- DTXSID
DTXSID20946411- Nikkaji
- J42.659H
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 84.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 416
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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