| CAS Number | 1246455-95-7 |
| Catalog Number | AG01EJ0Q |
| Chemical Name | 5-Methyl-1,4-oxazepane hydrochloride |
| IUPAC Name | 5-methyl-1,4-oxazepane;hydrochloride |
| InChI | InChI=1S/C6H13NO.ClH/c1-6-2-4-8-5-3-7-6;/h6-7H,2-5H2,1H3;1H |
| InChI Key | WYSIGZNUVPDDKA-UHFFFAOYSA-N |
| MDL Number | MFCD31456773 |
| Molecular Formula | C6H14ClNO |
| Molecular Weight | 151.6345 |
| SMILES | Cl.CC1NCCOCC1 |
| Synonyms | SCHEMBL537620,
WYSIGZNUVPDDKA-UHFFFAOYSA-N,
5-methyl-1,4-oxazepane hydrochloride,
5-methyl-[1,4]oxazepane hydrochloride,
1246455-95-7,
|
| Complexity | 65.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 151.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 151.634g/mol |
| Monoisotopic Mass | 151.076g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number