Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HCID 83192생성일: 2026년 10월 26일
4,6-Dichloro-2-methyl-5-nitropyrimidine
Einecs 236-105-5 · 2-Methyl-4,6-dichloro-5-nitropyrimidine · 4,6-Dichloro-2-methyl-5-nitropyrimidine · 2-Methyl-5-nitro-4,6-dichloro-pyriMidine · Pyrimidine, 4,6-dichloro-2-methyl-5-nitro- · 4,6-Dichloro-2-methyl-5-nitropyrimidine ISO 9001：2015 REACH · 4,6-Dichloro-2-methyl-5-nitropyrimidine4,6-Dichloro-2-methyl-5-nitropyrimidinev
https://huagongshe.com/ko/chemical/83192
식별자 및 물리적 특성
| CAS No. | 13162-43-1 |
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| 분자식 | C5H3Cl2N3O2 |
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| 평균 분자량 | 208 g/mol |
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| 단동위원소 질량 | 206.9602317 g/mol |
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| SMILES | Cc1nc(Cl)c([N+](=O)[O-])c(Cl)n1 |
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| InChIKey | OPXGPTXSLFZVCA-UHFFFAOYSA-N |
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| PubChem CID | 83192 |
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| EC No. | 236-105-5 |
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| DTXSID | DTXSID4065367 |
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화학 및 물리적 성질
| XLogP | 2.4 |
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| 극성 표면적 | 71.6 |
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| 수소 결합 공여자 수 | 0 |
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| 수소 결합 수용자 수 | 4 |
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| 회전 가능 결합 수 | 0 |
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| 무거운 원자 수 | 12 |
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| 형식 전하 | 0 |
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| 복잡도 | 174 |
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| 끓는 점 | 310.4±37.0 °C(Predicted) |
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| 밀도 | 1.626±0.06 g/cm3(Predicted) |
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| 저장 조건 | under inert gas (nitrogen or Argon) at 2-8°C |
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| pKa(산도 계수) | -7.02±0.39(Predicted) |
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| InChI | InChI=1S/C5H3Cl2N3O2/c1-2-8-4(6)3(10(11)12)5(7)9-2/h1H3 |
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| InChIKey | OPXGPTXSLFZVCA-UHFFFAOYSA-N |
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| SMILES | C1(C)=NC(Cl)=C([N+]([O-])=O)C(Cl)=N1 |
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| EPA | Pyrimidine, 4,6-dichloro-2-methyl-5-nitro- (13162-43-1) |
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안전 및 규제
| GHS 분류 | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, 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. 4 (100%)Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%) |
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| TSCA 등재 상태 | TSCA listed |
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