| CAS Number | 119130-94-8 |
| Catalog Number | AG00J3GL(AGN-PC-0PCW96) |
| Chemical Name | Potassium 1,3-benzoxazole-2-carboxylate |
| IUPAC Name | potassium;1,3-benzoxazole-2-carboxylate |
| InChI | InChI=1S/C8H5NO3.K/c10-8(11)7-9-5-3-1-2-4-6(5)12-7;/h1-4H,(H,10,11);/q;+1/p-1 |
| InChI Key | BJRBWXXVOQASLD-UHFFFAOYSA-M |
| MDL Number | MFCD18262311 |
| Molecular Formula | C8H4KNO3 |
| Molecular Weight | 201.2206 |
| SMILES | C1(C(=O)[O-])OC2C(=CC=CC=2)N=1.[K+] |
| Synonyms | potassium 1,3-benzoxazole-2-carboxylate,
119130-94-8,
Benzo[d]oxazole-2-carboxylic acid, potassium salt,
C8H4NO3.K,
ZX-CM014942,
7649AH,
MFCD20441325,
AKOS025147193,
potassium benzo[d]oxazole-2-carboxylate,
SC-21617,
Benzoxazole-2-carboxylic acid potassium salt,
F9995-2641,
Benzooxazole-2-carboxylic acid,
21598-08-3,
|
| Complexity | 200 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.983g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.222g/mol |
| Monoisotopic Mass | 200.983g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 66.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number