| CAS Number | 74706-77-7 |
| Catalog Number | AG00J1ML(AGN-PC-0U5WK5) |
| Chemical Name | 4-(1H-imidazol-1-yl)butanoic acid hydrochloride |
| IUPAC Name | 4-imidazol-1-ylbutanoic acid;hydrochloride |
| InChI | InChI=1S/C7H10N2O2.ClH/c10-7(11)2-1-4-9-5-3-8-6-9;/h3,5-6H,1-2,4H2,(H,10,11);1H |
| InChI Key | ZALJECPKFNYKDH-UHFFFAOYSA-N |
| MDL Number | MFCD11506466 |
| Molecular Formula | C7H11ClN2O2 |
| Molecular Weight | 190.6274 |
| SMILES | N1C=CN(CCCC(O)=O)C=1.Cl |
| Synonyms | 4-(1H-imidazol-1-yl)butanoic acid hydrochloride,
74706-77-7,
4-IMIDAZOL-1-YL-BUTYRIC ACID HYDROCHLORIDE,
SCHEMBL8891869,
CTK7J3621,
MFCD11506466,
AKOS015849821,
MCULE-6680198252,
NE40675,
TR-055730,
4-(imidazol-1-yl)butanoic acid hydrochloride,
EN300-62061,
F8889-4536,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.627g/mol |
| Monoisotopic Mass | 190.051g/mol |
| Rotatable Bond Count | 4 |
| 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