HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 528607Generated: November 3, 2026
N-Isopropylbutyramide
N-Isopropylbutyramide · N-(propan-2-yl)butanamide · N-(1-Methylethyl)butanamide · Butanamide, N-(1-methylethyl)-
https://huagongshe.com/en/chemical/528607
Identifiers & Physical Properties
| CAS No. | 122348-67-8 |
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| Molecular formula | C7H15NO |
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| Average molar mass | 129.2 g/mol |
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| Monoisotopic mass | 129.1153641 g/mol |
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| SMILES | CCCC(=O)NC(C)C |
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| InChIKey | KKWNADDVIBLENW-UHFFFAOYSA-N |
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| PubChem CID | 528607 |
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| DTXSID | DTXSID00336033 |
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Chemical & Physical Properties
| XLogP | 1.2 |
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| Topological polar surface area | 29.1 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 1 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 9 |
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| Formal charge | 0 |
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| Complexity | 88.9 |
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| Boiling point | 217.1℃ |
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| Density | 0.859 |
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| Flash point | 116.4℃ |
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| pKa (acidity coefficient) | 16.31±0.46(Predicted) |
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| GHS pictogram | GHS07 |
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| Signal word | Warning |
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| GHS hazard statements | H315-H319-H335 |
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| GHS precautionary statements | P261-P305+P351+P338 |
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| Customs code | 2924297099 |
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Safety & Regulations
| Customs code | 2924297099 |
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| Signal word | Warning |
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| GHS pictogram | GHS07 |
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| GHS hazard statements | H315-H319-H335 |
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| GHS precautionary statements | P261-P305+P351+P338 |
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