| CAS Number | 865188-30-3 |
| Catalog Number | AG01C3KH(AGN-PC-0OKFNI) |
| Chemical Name | (3R)-3-aminoheptanoic acid hydrochloride |
| IUPAC Name | 3-aminoheptanoic acid;hydrochloride |
| InChI | InChI=1S/C7H15NO2.ClH/c1-2-3-4-6(8)5-7(9)10;/h6H,2-5,8H2,1H3,(H,9,10);1H |
| InChI Key | RKLUJWKWWPBXAA-UHFFFAOYSA-N |
| MDL Number | MFCD29060499 |
| Molecular Formula | C7H16ClNO2 |
| Molecular Weight | 181.6604 |
| SMILES | Cl.CCCC[C@H](CC(O)=O)N |
| Synonyms | 3-aminoheptanoic acid hydrochloride,
80914-39-2,
(+/-)-cis-3-Aminoheptanoic acid hydrochloride,
(3R)-3-aminoheptanoic acid hydrochloride,
865188-30-3,
KS-00002BNC,
MFCD20489092,
AKOS030243376,
TS-7082,
3-aminoheptanoic acid hydrochloride (1:1),
(3R)-3-AMINOHEPTANOICACID,
|
| Complexity | 104 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.087g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.66g/mol |
| Monoisotopic Mass | 181.087g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 63.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number