| CAS Number | 1246527-48-9 |
| Catalog Number | AG01A9WT |
| Chemical Name | tert-Butyl 4-(methylamino)butanoate hydrochloride |
| IUPAC Name | tert-butyl 4-(methylamino)butanoate;hydrochloride |
| InChI | InChI=1S/C9H19NO2.ClH/c1-9(2,3)12-8(11)6-5-7-10-4;/h10H,5-7H2,1-4H3;1H |
| InChI Key | KYSYCXRCAOZNEL-UHFFFAOYSA-N |
| MDL Number | MFCD11045871 |
| Molecular Formula | C9H20ClNO2 |
| Molecular Weight | 209.7136 |
| SMILES | Cl.CNCCCC(=O)OC(C)(C)C |
| Synonyms | tert-butyl 4-(methylamino)butanoate hydrochloride,
1246527-48-9,
tert-butyl 4-(Methylamino)butanoate HCl,
AC1Q3BTS,
SCHEMBL411147,
KYSYCXRCAOZNEL-UHFFFAOYSA-N,
AKOS016907688,
MCULE-9382903133,
NE58749,
EN300-66397,
138007-25-7,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.118g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.714g/mol |
| Monoisotopic Mass | 209.118g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number