| CAS Number | 1260803-30-2 |
| Catalog Number | AG01BBSE |
| Chemical Name | 2-Aminopent-4-yn-1-ol |
| IUPAC Name | 2-aminopent-4-yn-1-ol |
| InChI | InChI=1S/C5H9NO/c1-2-3-5(6)4-7/h1,5,7H,3-4,6H2 |
| InChI Key | JCJYGCIFADHREE-UHFFFAOYSA-N |
| MDL Number | MFCD11040152 |
| Molecular Formula | C5H9NO |
| Molecular Weight | 99.1311 |
| SMILES | NC(CC#C)CO |
| Synonyms | 2-aminopent-4-yn-1-ol,
1260803-30-2,
AKOS006306287,
|
| Complexity | 81.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 99.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 99.133g/mol |
| Monoisotopic Mass | 99.068g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number