| CAS Number | 898403-15-1 |
| Catalog Number | AG00GVHE(AGN-PC-0WB6YK) |
| Chemical Name | 2-Methyl-2-(pyrrolidin-1-yl)propanoic acid |
| IUPAC Name | 2-methyl-2-pyrrolidin-1-ylpropanoic acid |
| InChI | InChI=1S/C8H15NO2/c1-8(2,7(10)11)9-5-3-4-6-9/h3-6H2,1-2H3,(H,10,11) |
| InChI Key | KBRCMVKZAFOGMG-UHFFFAOYSA-N |
| MDL Number | MFCD05230475 |
| Molecular Formula | C8H15NO2 |
| Molecular Weight | 157.2102 |
| SMILES | CC(C)(C(=O)O)N1CCCC1 |
| Synonyms | 2-methyl-2-(pyrrolidin-1-yl)propanoic acid,
898403-15-1,
2-Methyl-2-pyrrolidin-1-yl-propionic acid,
SCHEMBL3661207,
KBRCMVKZAFOGMG-UHFFFAOYSA-N,
ALBB-005645,
KS-000023KD,
STK500931,
ZINC11864126,
AKOS005171478,
BS-9738,
AJ-60294,
2-methyl-2-(1-pyrrolidinyl)propanoic acid,
alpha,alpha-Dimethyl-1-pyrrolidineacetic acid,
BB 0248894,
Y-1689,
2-methyl-2-pyrrolidin-1-ylpropanoic acid hydrochloride,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 157.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.213g/mol |
| Monoisotopic Mass | 157.11g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number