| CAS Number | 938251-34-4 |
| Catalog Number | AG019WRZ(AGN-PC-0WO4JI) |
| Chemical Name | 3-methyl-2-(4-methylpiperazin-1-yl)butanoic acid |
| IUPAC Name | 3-methyl-2-(4-methylpiperazin-1-yl)butanoic acid |
| InChI | InChI=1S/C10H20N2O2/c1-8(2)9(10(13)14)12-6-4-11(3)5-7-12/h8-9H,4-7H2,1-3H3,(H,13,14) |
| InChI Key | HSZTYVSVUYZRLR-UHFFFAOYSA-N |
| MDL Number | MFCD09717251 |
| Molecular Formula | C10H20N2O2 |
| Molecular Weight | 200.2780 |
| SMILES | CC(C(C(O)=O)N1CCN(C)CC1)C |
| Synonyms | 3-methyl-2-(4-methylpiperazin-1-yl)butanoic acid,
938251-34-4,
AC1Q1O4V,
CTK6I2925,
AKOS008115964,
MCULE-1842316635,
NE32987,
EN300-52961,
Z803145246,
|
| Complexity | 198 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.282g/mol |
| Monoisotopic Mass | 200.152g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number