| CAS Number | 1219237-63-4 |
| Catalog Number | AG00J1TL(AGN-PC-0WB6MW) |
| Chemical Name | 2-(Pyrrolidin-1-yl)butanoic acid hydrochloride |
| IUPAC Name | 2-pyrrolidin-1-ylbutanoic acid;hydrochloride |
| InChI | InChI=1S/C8H15NO2.ClH/c1-2-7(8(10)11)9-5-3-4-6-9;/h7H,2-6H2,1H3,(H,10,11);1H |
| InChI Key | POIDTVYBIYAITO-UHFFFAOYSA-N |
| MDL Number | MFCD09864568 |
| Molecular Formula | C8H16ClNO2 |
| Molecular Weight | 193.6711 |
| SMILES | N1(CCCC1)C(CC)C(O)=O.Cl |
| Synonyms | 1219237-63-4,
2-PYRROLIDIN-1-YL-BUTYRIC ACID HYDROCHLORIDE,
2-(1-Pyrrolidinyl)butanoic acid hydrochloride,
2-(pyrrolidin-1-yl)butanoic acid hydrochloride,
CTK6C7396,
1372AD,
MFCD09864568,
AKOS015849175,
MCULE-8225522753,
DB-071022,
TR-043152,
C8H16ClNO2,
PYRROLIDIN-1-YLBUTANOIC ACID HYDROCHLORIDE,
4-Pyrrolidin-1-yl-butyric acid; hydrochloride,
49637-21-0,
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.087g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.671g/mol |
| Monoisotopic Mass | 193.087g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number