| CAS Number | 91245-56-6 |
| Catalog Number | AG01C2J7 |
| Chemical Name | 3-ethyl-3-phenylazetidine hydrochloride |
| IUPAC Name | 3-ethyl-3-phenylazetidine;hydrochloride |
| InChI | InChI=1S/C11H15N.ClH/c1-2-11(8-12-9-11)10-6-4-3-5-7-10;/h3-7,12H,2,8-9H2,1H3;1H |
| InChI Key | YIVGLXUKVAZIIY-UHFFFAOYSA-N |
| MDL Number | MFCD11849050 |
| Molecular Formula | C11H16ClN |
| Molecular Weight | 197.7044 |
| SMILES | Cl.CCC1(C2=CC=CC=C2)CNC1 |
| Synonyms | 3-ethyl-3-phenylazetidine hydrochloride,
91245-56-6,
3-ethyl-3-phenyl-azetidine hydrochloride,
|
| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.097g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.706g/mol |
| Monoisotopic Mass | 197.097g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
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