| CAS Number | 1830344-45-0 |
| Catalog Number | AG01EK9R |
| Chemical Name | 4-(Dibutylamino)butanoic acid hydrochloride |
| IUPAC Name | 4-(dibutylamino)butanoic acid |
| InChI | InChI=1S/C12H25NO2/c1-3-5-9-13(10-6-4-2)11-7-8-12(14)15/h3-11H2,1-2H3,(H,14,15) |
| InChI Key | APLNOXBBAYPPBU-UHFFFAOYSA-N |
| MDL Number | MFCD09717951 |
| Molecular Formula | C12H26ClNO2 |
| Molecular Weight | 251.7933 |
| SMILES | Cl.CCCCN(CCCC(O)=O)CCCC |
| Synonyms | 4-(dibutylamino)butanoic acid,
1830344-45-0,
SBB077222,
|
| Complexity | 152 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.189g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.337g/mol |
| Monoisotopic Mass | 215.189g/mol |
| Rotatable Bond Count | 10 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number