3-(Butylamino)propionitrile
3-(butylamino)propanenitrile
Also Known As: 3-(Butylamino)propionitrile|3-(butylamino)propanenitrile|3-(n-butylamino)propionitrile|3-(BUTYLAMINO)-PROPIONITRILE|3-Butylamino-propanenitrile|3-Butylaminopropionitrile|3- PROPIONITRILE|Propanenitrile,3-(butylamino)-|3-(Butylamino)propiononitrile|Propanenitrile, 3-(butylamino)-|8245AE|Y-8617|I05-1238
CAS: 693-51-6
| Molecular Formula | CCCCNCCC#N |
|---|---|
| Molecular Weight | 126.1157 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 35.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 126.1157 |
| Monoisotopic Mass | 126.1157 |
| Heavy Atoms | 9 |
| Complexity | 90.0 |
Chemical Identifiers
| CAS Number | 693-51-6 |
|---|---|
| SMILES | CCCCNCCC#N |
| InChIKey | FPGVMJDQNJEAJM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (1 patents)
Dyes & Pigments (4 patents)
Heterocyclic Building Blocks (9 patents)
Organic Building Blocks (1 patents)
Pharmaceutical Intermediates (5 patents)
Plastic Additives (1 patents)
Polymer Intermediates (1 patents)
Textile Chemicals (1 patents)
Product Overview
3-(Butylamino)propionitrile (CAS 693-51-6), with molecular formula CCCCNCCC#N and molecular weight 126.1157 g/mol. IUPAC: 3-(butylamino)propanenitrile.
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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