| CAS Number | 1246456-02-9 |
| Catalog Number | AG00HHQM(AGN-PC-0WG3R5) |
| Chemical Name | 6-methyl-1,4-oxazepane hydrochloride |
| IUPAC Name | 6-methyl-1,4-oxazepane;hydrochloride |
| InChI | InChI=1S/C6H13NO.ClH/c1-6-4-7-2-3-8-5-6;/h6-7H,2-5H2,1H3;1H |
| InChI Key | GFLYPKSJXYATIR-UHFFFAOYSA-N |
| MDL Number | MFCD28119133 |
| Molecular Formula | C6H14ClNO |
| Molecular Weight | 151.6345 |
| SMILES | CC1CNCCOC1.[H]Cl |
| Synonyms | 1246456-02-9,
6-Methyl-1,4-oxazepane hydrochloride,
6-Methyl-1,4-oxazepane HCl,
SCHEMBL537421,
GFLYPKSJXYATIR-UHFFFAOYSA-N,
MFCD28119133,
6-methyl-[1,4]oxazepane hydrochloride,
6-methyl-1,4-oxazepane;hydrochloride,
|
| 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
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Certificate of Analysis
Lot Number