| CAS Number | 1269397-43-4 |
| Catalog Number | AG00J207 |
| Chemical Name | 7-amino-4-ethyl-2H-1,4-benzoxazin-3(4H)-one hydrochloride |
| IUPAC Name | 7-amino-4-ethyl-1,4-benzoxazin-3-one;hydrochloride |
| InChI | InChI=1S/C10H12N2O2.ClH/c1-2-12-8-4-3-7(11)5-9(8)14-6-10(12)13;/h3-5H,2,6,11H2,1H3;1H |
| InChI Key | RJTQTJJQRALUHM-UHFFFAOYSA-N |
| MDL Number | MFCD18483481 |
| Molecular Formula | C10H13ClN2O2 |
| Molecular Weight | 228.6754 |
| SMILES | N1(CC)C(=O)COC2=CC(N)=CC=C12.Cl |
| Synonyms | 7-amino-4-ethyl-2H-1,4-benzoxazin-3(4H)-one hydrochloride,
1269397-43-4,
SCHEMBL20703948,
ZX-CM007340,
MFCD18483481,
MCULE-2763981795,
7-Amino-4-ethyl-2H-1,4-benzoxazin-3(4H)-one hydrochloride, AldrichCPR,
233775-20-7,
|
| Complexity | 232 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.676g/mol |
| Monoisotopic Mass | 228.067g/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