| CAS Number | 1214838-86-4 |
| Catalog Number | AG019WO3(AGN-PC-0WO1MM) |
| Chemical Name | 3-methyl-2-(pyrrolidin-1-yl)butanoic acid hydrochloride |
| IUPAC Name | 3-methyl-2-pyrrolidin-1-ylbutanoic acid;hydrochloride |
| InChI | InChI=1S/C9H17NO2.ClH/c1-7(2)8(9(11)12)10-5-3-4-6-10;/h7-8H,3-6H2,1-2H3,(H,11,12);1H |
| InChI Key | LWGVJVSGHBXHDE-UHFFFAOYSA-N |
| MDL Number | MFCD12913132 |
| Molecular Formula | C9H18ClNO2 |
| Molecular Weight | 207.6977 |
| SMILES | Cl.CC(C(C(O)=O)N1CCCC1)C |
| Synonyms | 3-methyl-2-(pyrrolidin-1-yl)butanoic acid hydrochloride,
1214838-86-4,
CTK6A3647,
AC1Q3912,
AKOS026726613,
MCULE-5220491109,
NE15646,
EN300-52577,
Z763367876,
|
| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.698g/mol |
| Monoisotopic Mass | 207.103g/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