| CAS Number | 96144-21-7 |
| Catalog Number | AG01AHOO(AGN-PC-0W5RDK) |
| Chemical Name | 1H-Imidazole-1-propanoic acid, monohydrochloride |
| IUPAC Name | 3-imidazol-1-ylpropanoic acid;hydrochloride |
| InChI | InChI=1S/C6H8N2O2.ClH/c9-6(10)1-3-8-4-2-7-5-8;/h2,4-5H,1,3H2,(H,9,10);1H |
| InChI Key | LJTSCPQVRYTDRH-UHFFFAOYSA-N |
| MDL Number | MFCD05884968 |
| Molecular Formula | C6H9ClN2O2 |
| Molecular Weight | 176.6009 |
| SMILES | O=C(O)CCN1C=CN=C1.[H]Cl |
| Synonyms | 3-(1H-Imidazol-1-yl)propanoic acid hydrochloride,
3-IMIDAZOL-1-YL-PROPIONIC ACID HYDROCHLORIDE,
96144-21-7,
SCHEMBL17337465,
CTK7J4172,
imidazolepropionic acid hydrochloride,
AKOS015849820,
TR-049751,
3-(imidazol-1-yl)propanoic acid hydrochloride,
EN300-75342,
L-4436,
F1727-0263,
1H-Imidazole-1-propanoic acid,
18999-45-6,
|
| Complexity | 127 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 176.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.6g/mol |
| Monoisotopic Mass | 176.035g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number