| CAS Number | 1332531-66-4 |
| Catalog Number | AG01C1B0 |
| Chemical Name | 3-Amino-N-methylbutanamide hydrochloride |
| IUPAC Name | 3-amino-N-methylbutanamide;hydrochloride |
| InChI | InChI=1S/C5H12N2O.ClH/c1-4(6)3-5(8)7-2;/h4H,3,6H2,1-2H3,(H,7,8);1H |
| InChI Key | NQEFXRFCVFZOIM-UHFFFAOYSA-N |
| MDL Number | MFCD19103383 |
| Molecular Formula | C5H13ClN2O |
| Molecular Weight | 152.6225 |
| SMILES | Cl.CNC(CC(N)C)=O |
| Synonyms | 3-amino-N-methylbutanamide hydrochloride,
1332531-66-4,
54758-64-4,
SCHEMBL6044876,
5418AE,
MFCD19103383,
AKOS025405294,
Z1457935170,
C5H13ClN2O,
|
| Complexity | 82.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 152.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 152.622g/mol |
| Monoisotopic Mass | 152.072g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
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