HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 178668564Generated: October 30, 2026
2-(Methylamino)-2-phenylacetonitrile hydrochloride
Methylamino-phenyl-acetonitrile · Methylamino-phenyl-acetonitrile hydrochloride
https://huagongshe.com/en/chemical/178668564
Identifiers & Physical Properties
| CAS No. | 5537-52-0 |
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| Molecular formula | C9H11ClN2 |
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| Average molar mass | 182.65 g/mol |
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| Monoisotopic mass | 182.0610761 g/mol |
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| SMILES | CNC(C#N)c1ccccc1.Cl |
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| InChIKey | HRRDHPMAFBTHOH-UHFFFAOYSA-N |
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| PubChem CID | 50998894 |
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Chemical & Physical Properties
| Topological polar surface area | 35.8 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 2 |
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| Rotatable bonds | 2 |
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| Heavy atoms | 12 |
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| Formal charge | 0 |
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| Complexity | 150 |
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| Hazard class | IRRITANT |
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| Customs code | 2926907090 |
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Safety & Regulations
| Customs code | 2926907090 |
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| Hazard class | IRRITANT |
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