| CAS Number | 916211-08-0 |
| Catalog Number | AG00H33R(AGN-PC-0WCZXH) |
| Chemical Name | 6-(AMinoMethyl)-4-Methyl-2H-benzo[b][1,4]oxazin-3(4H)-one hydrochloride |
| IUPAC Name | 6-(aminomethyl)-4-methyl-1,4-benzoxazin-3-one;hydrochloride |
| InChI | InChI=1S/C10H12N2O2.ClH/c1-12-8-4-7(5-11)2-3-9(8)14-6-10(12)13;/h2-4H,5-6,11H2,1H3;1H |
| InChI Key | CGCXCHFJTSWQLA-UHFFFAOYSA-N |
| MDL Number | MFCD20278300 |
| Molecular Formula | C10H13ClN2O2 |
| Molecular Weight | 228.6754 |
| SMILES | Cl.CN1C(=O)COc2ccc(CN)cc12 |
| Synonyms | 916211-08-0,
6-(AMinoMethyl)-4-Methyl-2H-benzo[b][1,4]oxazin-3(4H)-one hydrochloride,
6-Aminomethyl-4-methyl-4H-benzo[1,4]oxazin-3-one hydrochloride,
6-(AMINOMETHYL)-4-METHYL-2H-BENZO[B][1,4]OXAZIN-3(4H)-ONE HCL,
DTXSID10745132,
3335AJ,
MFCD14551329,
AS-36611,
AX8213086,
Z-7074,
6-Aminomethyl-4-methyl-4H-benzo[1,4oxazin-3-one hydrochloride,
6-(Aminomethyl)-4-methyl-2H-1,4-benzoxazin-3(4H)-one--hydrogen chloride (1/1),
6-(aminomethyl)-4-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-one hydrochloride,
C10H12N2O2.HCl,
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| 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 |
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Certificate of Analysis
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