| CAS Number | 1385696-59-2 |
| Catalog Number | AG01C1QR |
| Chemical Name | 4-Benzyltetrahydro-2H-pyran-4-amine hydrochloride |
| IUPAC Name | 4-benzyloxan-4-amine;hydrochloride |
| InChI | InChI=1S/C12H17NO.ClH/c13-12(6-8-14-9-7-12)10-11-4-2-1-3-5-11;/h1-5H,6-10,13H2;1H |
| InChI Key | WSHJMVLXDYSMTA-UHFFFAOYSA-N |
| MDL Number | MFCD22418747 |
| Molecular Formula | C12H18ClNO |
| Molecular Weight | 227.7304 |
| SMILES | Cl.C(C1=CC=CC=C1)C1(CCOCC1)N |
| Synonyms | 4-Benzyloxan-4-amine hydrochloride,
1385696-59-2,
AKOS027393498,
KS-7498,
Z2238934556,
|
| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.732g/mol |
| Monoisotopic Mass | 227.108g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number