Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
염화옥살릴
염화옥살릴 · 옥살릴염화물 · 옥살산디클로라이드 · 이염화옥살릴 · OXALYL DICHLORIDE · Oxalyl · formyl chloride · OC
식별자 및 물리적 특성
| CAS No. | 79-37-8 |
|---|---|
| 분자식 | C2Cl2O2 |
| 평균 분자량 | 126.92 g/mol |
| 단동위원소 질량 | 125.9275346 g/mol |
| SMILES | O=C(Cl)C(=O)Cl |
| InChIKey | CTSLXHKWHWQRSH-UHFFFAOYSA-N |
| PubChem CID | 65578 |
| EC No. | 201-200-2 |
| DTXSID | DTXSID3058822 |
| 현지명 | 염화옥살릴 |
화학 및 물리적 성질
| XLogP | 1.7 |
|---|---|
| 극성 표면적 | 34.1 |
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 2 |
| 회전 가능 결합 수 | 1 |
| 무거운 원자 수 | 6 |
| 형식 전하 | 0 |
| 복잡도 | 75.5 |
| 물질 분류 | Toxic Gases & Vapors -> Acid Halides |
| SpringerMaterials Properties | Schoenflies notation |
| 밀도 | 1.4785 @ 20°C1.5 g/mL at 20 °C (lit.) |
| 끓는 점 | 63.5 °C @760 [mm Hg]62-65 °C (lit.) |
| 녹는점 | -16 °C-10--8 °C (lit.) |
| 증기압 | 150.0 [mmHg]150 mm Hg ( 20 °C) |
| Physical Description | LiquidColorless fuming liquid with a penetrating odor[Merck Index] |
| 증기 밀도 | 4.4 (vs air) |
| 굴절률 | n20/D 1.429(lit.) |
| 인화점 | 176-178°C |
| 저장 조건 | Store Cold |
| 용해도 | 에 용해됨클로로포름, 에틸아세테이트 |
| 물리적 상태 | 액체 |
| 색상 | APHA: 0-150 |
| 냄새 | 침투하는 냄새 |
| 용해도 | 물과 반응 |
| Merck | 14,6914 |
| BRN | 1361988 |
| 유전율 | 3.5(21℃) |
| 안정성 | 안정적인. 염기, 알코올, 강철, 산화제, 알칼리 금속과 호환되지 않습니다. 수분에 민감합니다. 물과 격렬하게 반응하여 유독가스를 방출함. |
| InChI | 1S/C2Cl2O2/c3-1(5)2(4)6 |
| InChIKey | CTSLXHKWHWQRSH-UHFFFAOYSA-N |
| SMILES | ClC(=O)C(Cl)=O |
| NIST | Oxalyl chloride(79-37-8) |
| EPA | Ethanedioyl dichloride (79-37-8) |
화학적 성질
colourless liquid with a pungent odour
안전 및 규제
| GHS 분류 | DangerH260 (60%): In contact with water releases flammable gases which may ignite spontaneously [Danger Substances and mixtures which in contact with water, emit flammable gases]P223, P231+P232, P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P330+P331, P302+P335+P334, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P363, P370+P378, P402+P404, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 300 reports by companies from 34 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| 규제 정보 | Chemical: Ethanedioyl dichlorideEthanedioyl dichloride is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Ethanedioyl dichloride 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)Status: Active Update: 04-03-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/12537Oxalyl chloride: Does not have an individual approval but may be used under an appropriate group standard |
| 유해성 요약 | Causes corneal damage and dyspnea in inhalation lethal-concentration studies of rats[RTECS] Decomposed violently by waterA severe skin, eye, and respiratory tract irritantToxic[Merck Index] Reacts violently with water evolving toxic gasCauses burnsInhalation may cause corrosive injuries to upper respiratory tract and lungsToxic by inhalation[Sigma-Aldrich MSDS] See Oxalic acid. |
| Hazard Classes and Categories | Water-react. 1 (60%) |
| CSL Reaction Information | CSL00032N,N-DIMETHYLFORMAMIDE + OXALYL CHLORIDEHealth HazardHarmful,ToxicChlorinationGeneration of dimethylcarbamoyl chloride (carcinogen). DMCC is also toxic and a severe irritant. |
| Protective Action Criteria (PAC) | 0.77 [ppm]8.5 [ppm]51 [ppm] |
| 유해 작용 | Dermatotoxin - Skin burns. |
| Toxicity Data | LC50 (rat) = 1,840 ppm/1hr |
| 수질 위해 등급(WGK) | 2 |
| TSCA 등재 상태 | TSCA listed |
| RTECS 번호 | KI2950000 |
| 운송 번호(UN) | UN 2927 6.1/PG 2 |
| 관세 코드 | 29171990 |
| 위험 문구(R) | 14-20-29-34-40-23/24/25-37-35-23 |
| 위험 표시 | C,T |
| 안전 문구(S) | 26-36/37/39-43-45-8-24/25-23-27 |
| 포장분류 | II |
| 위험 등급 | 8Acute Tox. 3 InhalationAcute Tox. 3 OralEye Dam. 1Skin Corr. 1BWater-react 1 |
| 기존화학 물질 | KE-13137 |
| F 고인화성물질 | 9-19-21 |
| 위험 참고 사항 | Toxic/Corrosive/Store Cold/Lacrymatory |
| 저장 분류 | 4.3 - Hazardous materials which set free flammable gases upon contact with water |
용도
용도
Oxalyl Chloride is used in the preparation of cardiolipin analogs which induce peroxidase activity by Cytochrome C. It is also used in the preparation of fluorescent indicators for cytosolic calcium.
일반 설명
Oxalyl chloride is a commonly used chlorinating reagent that can be prepared by the reaction of oxalic acid and phosphorus pentachloride.
제조 및 합성 방법
생산 방법
Oxalyl Chloride is produced by the reaction of anhydrous oxalic acid and phosphorus pentachloride.