| CAS Number | 54620-70-1 |
| Catalog Number | AG01DEGL |
| Chemical Name | 5-Hydroxypent-2-ynoic acid |
| IUPAC Name | 5-hydroxypent-2-ynoic acid |
| InChI | InChI=1S/C5H6O3/c6-4-2-1-3-5(7)8/h6H,2,4H2,(H,7,8) |
| InChI Key | QEZWEEYWBFNZNO-UHFFFAOYSA-N |
| MDL Number | MFCD19228729 |
| Molecular Formula | C5H6O3 |
| Molecular Weight | 114.0993 |
| SMILES | O=C(O)C#CCCO |
| Synonyms | 5-hydroxypent-2-ynoic Acid,
54620-70-1,
5-hydroxy-pent-2-ynoic acid,
SCHEMBL17202169,
AKOS006378621,
NS-00112,
CID11094571,
|
| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 114.032g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 114.1g/mol |
| Monoisotopic Mass | 114.032g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 57.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number