| CAS Number | 1956306-28-7 |
| Catalog Number | AG01DIVF |
| Chemical Name | 2-(Azocan-1-yl)-2-phenylacetic acid hydrochloride |
| IUPAC Name | 2-(azocan-1-yl)-2-phenylacetic acid;hydrochloride |
| InChI | InChI=1S/C15H21NO2.ClH/c17-15(18)14(13-9-5-4-6-10-13)16-11-7-2-1-3-8-12-16;/h4-6,9-10,14H,1-3,7-8,11-12H2,(H,17,18);1H |
| InChI Key | LAKWCPKGJHLVJL-UHFFFAOYSA-N |
| MDL Number | MFCD28991772 |
| Molecular Formula | C15H22ClNO2 |
| Molecular Weight | 283.7937 |
| SMILES | OC(=O)C(c1ccccc1)N1CCCCCCC1.Cl |
| Synonyms | 2-(AZOCAN-1-YL)-2-PHENYLACETIC ACID HCL,
1956306-28-7,
2-(Azocan-1-yl)-2-phenylacetic acid hydrochloride,
MFCD28991772,
|
| Complexity | 253 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 283.134g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 283.796g/mol |
| Monoisotopic Mass | 283.134g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number