| CAS Number | 1864058-21-8 |
| Catalog Number | AG01AP1D |
| Chemical Name | 2-Aminobut-3-yn-1-ol hydrochloride |
| IUPAC Name | 2-aminobut-3-yn-1-ol;hydrochloride |
| InChI | InChI=1S/C4H7NO.ClH/c1-2-4(5)3-6;/h1,4,6H,3,5H2;1H |
| InChI Key | RYXAXGYGXKDYOX-UHFFFAOYSA-N |
| MDL Number | MFCD29034357 |
| Molecular Formula | C4H8ClNO |
| Molecular Weight | 121.5654 |
| SMILES | Cl.NC(C#C)CO |
| Synonyms | 2-Aminobut-3-yn-1-ol hydrochloride,
1864058-21-8,
(R)-2-Aminobut-3-yn-1-ol hydrochloride,
(S)-2-Aminobut-3-yn-1-ol hydrochloride,
1956436-39-7,
898818-92-3,
2-Aminobut-3-yn-1-ol HCl,
MFCD29034357,
AKOS026746424,
F2147-3893,
Z2235790715,
|
| Complexity | 70.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 121.029g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 121.564g/mol |
| Monoisotopic Mass | 121.029g/mol |
| Rotatable Bond Count | 1 |
| 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