| CAS Number | 98137-47-4 |
| Catalog Number | AG01AGQB(AGN-PC-0WOUUY) |
| Chemical Name | 2-(Aminomethyl)butanoic acid hydrochloride |
| IUPAC Name | 2-(aminomethyl)butanoic acid;hydrochloride |
| InChI | InChI=1S/C5H11NO2.ClH/c1-2-4(3-6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8);1H |
| InChI Key | XZLAGEBUTYNRAA-UHFFFAOYSA-N |
| MDL Number | MFCD18089524 |
| Molecular Formula | C5H12ClNO2 |
| Molecular Weight | 153.6073 |
| SMILES | Cl.CCC(C(O)=O)CN |
| Synonyms | 2-(aminomethyl)butanoic acid hydrochloride,
98137-47-4,
AC1Q39MN,
SCHEMBL2651955,
XZLAGEBUTYNRAA-UHFFFAOYSA-N,
AKOS026744084,
NE55644,
ethyl 3-aminopropanoic acid hydrochloride,
ethyl 3-aminopropionic acid hydrochloride,
2-aminomethyl-butyric acid ; hydrochloride,
EN300-72555,
2-aminomethyl-butyric acid hydrochloride,
|
| Complexity | 82.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 153.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 153.606g/mol |
| Monoisotopic Mass | 153.056g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 63.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number