| CAS Number | 22050-03-9 |
| Catalog Number | AG007PZ6(AGN-PC-00NHAQ) |
| Chemical Name | 4-Amino-2-methylbutanoic Acid Hydrochloride |
| IUPAC Name | 4-amino-2-methylbutanoic acid;hydrochloride |
| InChI | InChI=1S/C5H11NO2.ClH/c1-4(2-3-6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8);1H |
| InChI Key | SWNMNSZJSKBCLH-UHFFFAOYSA-N |
| MDL Number | MFCD18082965 |
| Molecular Formula | C5H12ClNO2 |
| Molecular Weight | 153.6073 |
| SMILES | Cl.NCCC(C(=O)O)C |
| Synonyms | 22050-03-9,
4-amino-2-methylbutanoic acid hydrochloride,
rac 4-Amino-2-methyl-butyric acid hydrochloride,
SCHEMBL362691,
CTK0J6808,
DTXSID70545493,
4-Amino-2-methyl-butyric acid HCl,
MFCD18082965,
AKOS026672066,
MCULE-8098419324,
RP21774,
rac 4-Amino-2-methyl-butyric acid x HCl,
Butanoic acid, 4-amino-2-methyl-, hydrochloride,
4-Amino-2-methylbutanoic acid--hydrogen chloride (1/1),
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| 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
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Certificate of Analysis
Lot Number