| CAS Number | 1343594-61-5 |
| Catalog Number | AG01C51F |
| Chemical Name | 2-AMINOHEX-4-YN-1-OL |
| IUPAC Name | 2-aminohex-4-yn-1-ol |
| InChI | InChI=1S/C6H11NO/c1-2-3-4-6(7)5-8/h6,8H,4-5,7H2,1H3 |
| InChI Key | SCELGGPWOLAFFS-UHFFFAOYSA-N |
| MDL Number | MFCD20350520 |
| Molecular Formula | C6H11NO |
| Molecular Weight | 113.1576 |
| SMILES | CC#CCC(CO)N |
| Synonyms | 2-aminohex-4-yn-1-ol,
1343594-61-5,
AKOS013899681,
CS-0091348,
|
| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 113.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 113.16g/mol |
| Monoisotopic Mass | 113.084g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number