| CAS Number | 92288-70-5 |
| Catalog Number | AG00H56P(AGN-PC-01VTGD) |
| Chemical Name | 2-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]acetic acid |
| IUPAC Name | 2-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]acetic acid |
| InChI | InChI=1S/C11H11NO4/c13-10(14)7-8-1-3-9(4-2-8)12-5-6-16-11(12)15/h1-4H,5-7H2,(H,13,14) |
| InChI Key | HNCWJYWZNGZHAD-UHFFFAOYSA-N |
| MDL Number | MFCD11167845 |
| Molecular Formula | C11H11NO4 |
| Molecular Weight | 221.2093 |
| SMILES | OC(CC1=CC=C(N2C(=O)OCC2)C=C1)=O |
| Synonyms | 92288-70-5,
2-(4-(2-oxooxazolidin-3-yl)phenyl)acetic acid,
2-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]acetic acid,
SCHEMBL1533556,
HNCWJYWZNGZHAD-UHFFFAOYSA-N,
ZINC20213294,
AKOS009222339,
DA-00952,
FT-0755761,
Benzeneaceticacid,4-(2-oxo-3-oxazolidinyl)-,
Benzeneacetic acid, 4-(2-oxo-3-oxazolidinyl)-,
[4-(2-Oxo-1,3-oxazolidin-3-yl)phenyl]acetic Acid,
|
| Complexity | 284 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.212g/mol |
| Monoisotopic Mass | 221.069g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number