| CAS Number | 1461689-20-2 |
| Catalog Number | AG01A70M(AGN-PC-0WOTR5) |
| Chemical Name | (2S)-2-Amino-3-cycloheptyl-propanoic acid hydrochloride |
| IUPAC Name | (2S)-2-amino-3-cycloheptylpropanoic acid;hydrochloride |
| InChI | InChI=1S/C10H19NO2.ClH/c11-9(10(12)13)7-8-5-3-1-2-4-6-8;/h8-9H,1-7,11H2,(H,12,13);1H/t9-;/m0./s1 |
| InChI Key | IRYFVVIIPWXKCT-FVGYRXGTSA-N |
| MDL Number | MFCD25970498 |
| Molecular Formula | C10H20ClNO2 |
| Molecular Weight | 221.7243 |
| SMILES | O=C(O)[C@@H](N)CC1CCCCCC1.[H]Cl |
| Synonyms | (2S)-2-amino-3-cycloheptylpropanoic acid hydrochloride,
1461689-20-2,
AKOS026743330,
MCULE-5328740745,
NE36907,
Z1762997304,
|
| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.118g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.725g/mol |
| Monoisotopic Mass | 221.118g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 63.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number