| CAS Number | 1803604-38-7 |
| Catalog Number | AG01B1I3(AGN-PC-0WOWE0) |
| Chemical Name | 3-(1H-1,2,3-Triazol-1-yl)Propanoic Acid Hydrochloride |
| IUPAC Name | 3-(triazol-1-yl)propanoic acid;hydrochloride |
| InChI | InChI=1S/C5H7N3O2.ClH/c9-5(10)1-3-8-4-2-6-7-8;/h2,4H,1,3H2,(H,9,10);1H |
| InChI Key | HDNUTZJBAVJXIL-UHFFFAOYSA-N |
| MDL Number | MFCD27980923 |
| Molecular Formula | C5H8ClN3O2 |
| Molecular Weight | 177.5889 |
| SMILES | C1=CN(N=N1)CCC(=O)O.Cl |
| Synonyms | 3-(1H-1,2,3-triazol-1-yl)propanoic acid hydrochloride,
1803604-38-7,
AKOS026745132,
NE17274,
|
| Complexity | 128 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.031g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.588g/mol |
| Monoisotopic Mass | 177.031g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 68A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number