2-Heptynal
hept-2-ynal
Also Known As: 2-Heptynal|hept-2-ynal|Heptalin|Butylpropiolaldehyd|2-Heptynal #|Hept-2-yn-1-al
CAS: 1846-67-9
| Molecular Formula | C7H10O |
|---|---|
| Molecular Weight | 110.073166 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 110.073166 |
| Monoisotopic Mass | 110.073166 |
| Heavy Atoms | 8 |
| Complexity | 113.0 |
Chemical Identifiers
| CAS Number | 1846-67-9 |
|---|---|
| SMILES | CCCCC#CC=O |
| InChIKey | XWZLMLGAYCVWAU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (9 patents)
Heterocyclic Building Blocks (2 patents)
Organic Building Blocks (16 patents)
Pharmaceutical Intermediates (31 patents)
Product Overview
2-Heptynal (CAS 1846-67-9), with molecular formula C7H10O and molecular weight 110.073166 g/mol. IUPAC: hept-2-ynal.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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