| CAS Number | 537657-97-9 |
| Catalog Number | AG00DL8X(AGN-PC-03MUXC) |
| Chemical Name | 3-(2-oxo-1,3-oxazolidin-3-yl)benzoic acid |
| IUPAC Name | 3-(2-oxo-1,3-oxazolidin-3-yl)benzoic acid |
| InChI | InChI=1S/C10H9NO4/c12-9(13)7-2-1-3-8(6-7)11-4-5-15-10(11)14/h1-3,6H,4-5H2,(H,12,13) |
| InChI Key | KETFZTDHSKCSAT-UHFFFAOYSA-N |
| MDL Number | MFCD11167854 |
| Molecular Formula | C10H9NO4 |
| Molecular Weight | 207.1828 |
| SMILES | OC(C1=CC(N2C(=O)OCC2)=CC=C1)=O |
| Synonyms | 3-(2-oxo-1,3-oxazolidin-3-yl)benzoic acid,
537657-97-9,
Benzoic acid, 3-(2-oxo-3-oxazolidinyl)-,
3-(2-oxo-3-oxazolidinyl)Benzoic acid,
AC1Q72TL,
SCHEMBL1962849,
CTK7H7464,
KETFZTDHSKCSAT-UHFFFAOYSA-N,
ZINC20213334,
AKOS009221827,
3-(2-Oxooxazolidin-3-yl)benzoic Acid,
MCULE-7961068446,
NE15033,
FT-0766431,
EN300-40024,
Z815264232,
|
| Complexity | 279 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.185g/mol |
| Monoisotopic Mass | 207.053g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number