| CAS Number | 25589-27-9 |
| Catalog Number | AG01AKBV |
| Chemical Name | 1-Amino-3-methylbutan-2-ol hydrochloride |
| IUPAC Name | 1-amino-3-methylbutan-2-ol;hydrochloride |
| InChI | InChI=1S/C5H13NO.ClH/c1-4(2)5(7)3-6;/h4-5,7H,3,6H2,1-2H3;1H |
| InChI Key | ADXXZLQTMIOJSY-UHFFFAOYSA-N |
| MDL Number | MFCD19982510 |
| Molecular Formula | C5H14ClNO |
| Molecular Weight | 139.6238 |
| SMILES | CC(C)C(O)CN.Cl |
| Synonyms | 1-amino-3-methylbutan-2-ol hydrochloride,
1-Amino-3-methyl-2-butanol hydrochloride,
25589-27-9,
SCHEMBL19642616,
1-Amino-3-methyl-2-butanol HCl,
AKOS016908645,
MCULE-3560246402,
NE16558,
EN300-83401,
17687-58-0,
|
| Complexity | 45.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 139.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 139.623g/mol |
| Monoisotopic Mass | 139.076g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number