HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 178733031Generated: October 23, 2026
2,5-Dimethoxyaniline
Benzenamine, 2,5-dimethoxy-, radical ion(1+) (9CI)
https://huagongshe.com/en/chemical/178733031
Identifiers & Physical Properties
| CAS No. | 102526-87-4 |
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| Molecular formula | C8H11NO2 |
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| Average molar mass | 153.18 g/mol |
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| SMILES | COc1ccc(OC)c(N)c1 |
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| InChIKey | NAZDVUBIEPVUKE-UHFFFAOYSA-N |
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| ChEMBL | CHEMBL1616799 |
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| EC No. | 203-040-9 |
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Chemical & Physical Properties
| XLogP | 1.2 |
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| Topological polar surface area | 44.5 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 3 |
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| Rotatable bonds | 2 |
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| Heavy atoms | 11 |
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| Formal charge | 0 |
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| Complexity | 119 |
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| Chemical classes | Nitrogen Compounds -> Amines, Aromatic |
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| SpringerMaterials Properties | Density |
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| LogP (partition coefficient) | 1.2 |
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| Vapor pressure | 0.00828 [mmHg] |
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| Physical Description | Brown powder[Alfa Aesar MSDS] |
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Safety & Regulations
| GHS classification | DangerH301 (88.5%): Toxic if swallowed [Danger Acute toxicity, oral]P260, P264, P270, P301+P316, P301+P317, P319, P321, P330, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 52 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Regulatory information | Chemical: Benzenamine, 2,5-dimethoxy-Status: Active Update: 27-06-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/5256Benzenamine, 2,5-dimethoxy-: Does not have an individual approval but may be used under an appropriate group standard |
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| Hazards summary | Causes somnolence, methemoglobinemia, liver and kidney changes, and general anesthesia in acute oral studies of mice[RTECS] May cause irritationMay induce methemoglobinemiaToxic by ingestion, inhalation, and skin absorptionProlonged or repeated exposure may cause organ injury[Alfa Aesar MSDS] |
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| Hazard Classes and Categories | Acute Tox. 3 (88.5%) |
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| Adverse effects | Neurotoxin - Other CNS neurotoxin |
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