HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 17813Generated: November 4, 2026
(2-Methoxybenzylidene)malononitrile
2-(2-methoxybenzylidene)malononitrile · 2-Methoxybenzylidenemalononitrile · (2-methoxybenzylidene)propanedinitrile · 2-(2-Methoxybenzylidene)propanedinitrile · Propanedinitrile, 2-[(2-methoxyphenyl)methylene]-
https://huagongshe.com/en/chemical/17813
Identifiers & Physical Properties
| CAS No. | 2834-10-8 |
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| Molecular formula | C11H8N2O |
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| Average molar mass | 184.19 g/mol |
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| Monoisotopic mass | 184.06366288 g/mol |
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| SMILES | COc1ccccc1C=C(C#N)C#N |
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| InChIKey | YCZZNGRKFVBLDL-UHFFFAOYSA-N |
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| PubChem CID | 17813 |
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| EC No. | 167-644-3 |
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| DTXSID | DTXSID60182578 |
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Chemical & Physical Properties
| XLogP | 1.8 |
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| Topological polar surface area | 56.8 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 3 |
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| Rotatable bonds | 2 |
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| Heavy atoms | 14 |
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| Formal charge | 0 |
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| Complexity | 297 |
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| Melting point | 84-85 °C |
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| Boiling point | 335.8±27.0 °C(Predicted) |
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| Density | 1.169±0.06 g/cm3(Predicted) |
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Safety & Regulations
| GHS classification | DangerH301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Acute Tox. 3 (100%) |
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