Penta-2,4-diyn-1-yl 3,5-dihydroxybenzoate
penta-2,4-diynyl 3,5-dihydroxybenzoate
Also Known As: 2,4-Pentadiyn-1-yl 3,5-dihydroxybenzoate|Penta-2,4-diynyl 3,5-dihydroxybenzoate|Penta-2,4-diyn-1-yl 3,5-dihydroxybenzoate|J1.967.010D|3,5-Dihydroxybenzoic acid 2,4-pentadiynyl ester|3,5-Dihydroxybenzoic acid penta-2,4-diynyl ester|Benzoic acid, 3,5-dihydroxy-, 2,4-pentadiynyl ester (9CI)|Benzoic acid,3,5-dihydroxy-,2,4-pentadiynyl ester (9CI)
CAS: 623176-87-4
| Molecular Formula | C12H8O4 |
|---|---|
| Molecular Weight | 216.04225 g/mol |
| LogP | 0.8912 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.04225 |
| Monoisotopic Mass | 216.04225 |
| Heavy Atoms | 16 |
| Complexity | 479.72565 |
Chemical Identifiers
| CAS Number | 623176-87-4 |
|---|---|
| SMILES | C#CC#CCOC(=O)C1=CC(=CC(=C1)O)O |
Product Overview
Penta-2,4-diyn-1-yl 3,5-dihydroxybenzoate (CAS 623176-87-4), with molecular formula C12H8O4 and molecular weight 216.04225 g/mol. IUPAC: penta-2,4-diynyl 3,5-dihydroxybenzoate.
Safety Data Sheet (MSDS / SDS)
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