식별자 및 물리적 특성
| CAS No. | 471-46-5 |
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| 분자식 | C2H4N2O2 |
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| 평균 분자량 | 88.07 g/mol |
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| 단동위원소 질량 | 88.02727738 g/mol |
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| SMILES | NC(=O)C(N)=O |
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| InChIKey | YIKSCQDJHCMVMK-UHFFFAOYSA-N |
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| PubChem CID | 10113 |
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| ChEMBL | CHEMBL1995464 |
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| ChEBI | CHEBI:48248 |
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| EC No. | 207-442-5 |
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| DTXSID | DTXSID1060051 |
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화학 및 물리적 성질
| XLogP | -1.6 |
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| 극성 표면적 | 86.2 |
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| 수소 결합 공여자 수 | 2 |
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| 수소 결합 수용자 수 | 2 |
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| 회전 가능 결합 수 | 0 |
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| 무거운 원자 수 | 6 |
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| 형식 전하 | 0 |
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| 복잡도 | 75 |
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| 밀도 | 1.667 @ 20°C1.667 g/cm3 |
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| 증기압 | 0.00000006 [mmHg] |
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| Physical Description | CBISolid[Merck Index] Beige powder[Sigma-Aldrich MSDS] |
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| 녹는점 | 350 °C (decomp) |
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| 끓는 점 | 262.7±23.0 °C(Predicted) |
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| pKa(산도 계수) | 13.28±0.50(Predicted) |
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안전 및 규제
| GHS 분류 | WarningH302 (91.7%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (93.8%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (93.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 48 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
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| 규제 정보 | Chemical: EthanediamideCommission Regulation (EC) No 451/2000Ethanediamide is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Ethanediamide are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Oxamide: Does not have an individual approval but may be used under an appropriate group standard |
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| 유해성 요약 | A moderate eye irritantIntraperitoneal LD50 (rat) > 500 mg/kg[RTECS] Induces hydronephrosis in rat kidneys. [ChemIDplus] A skin and strong eye irritantHarmful by ingestion[Sigma-Aldrich MSDS] See Rubeanic acid. See Oxalic acid. |
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| Hazard Classes and Categories | Acute Tox. 4 (91.7%)Skin Irrit. 2 (93.8%)Eye Irrit. 2 (93.8%) |
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| Protective Action Criteria (PAC) | 1.3 [mg/m3]15 [mg/m3]89 [mg/m3] |
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