| CAS Number | 1269087-70-8 |
| Catalog Number | AG00J2EC(AGN-PC-0WBECH) |
| Chemical Name | 6-Amino-3-ethyl-1,3-benzoxazol-2(3H)-one hydrochloride |
| IUPAC Name | 6-amino-3-ethyl-1,3-benzoxazol-2-one;hydrochloride |
| InChI | InChI=1S/C9H10N2O2.ClH/c1-2-11-7-4-3-6(10)5-8(7)13-9(11)12;/h3-5H,2,10H2,1H3;1H |
| InChI Key | BVADWVOMHZRPFL-UHFFFAOYSA-N |
| MDL Number | MFCD24386252 |
| Molecular Formula | C9H11ClN2O2 |
| Molecular Weight | 214.6488 |
| SMILES | C1(=O)OC2C(=CC=C(N)C=2)N1CC.Cl |
| Synonyms | 1269087-70-8,
6-Amino-3-ethyl-1,3-benzoxazol-2(3H)-one hydrochloride,
ZX-CM009292,
MFCD18483560,
AKOS024397682,
MCULE-9407187025,
|
| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.649g/mol |
| Monoisotopic Mass | 214.051g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 55.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number