기본 정보
- 표준 SMILES
ClC(Cl)(Br)C(Cl)(Cl)Br- InChIKey
WJUKOGPNGRUXMG-UHFFFAOYSA-N- 분자식
- C2Br2Cl4
- 평균 분자량
- 325.6 g/mol
- 단동위원소 질량
- 321.71208492
개요
structure in first source
이름 및 식별자
- 우선 이름
- 1,2-Dibromo-1,1,2,2-tetrachloroethane
- IUPAC
- 1,2-dibromo-1,1,2,2-tetrachloroethane
- 영어명
- 1,2-Dibromotetrachloroethane
- 분자식
- C2Br2Cl4
- 분자량
- 325.64
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
630-25-1- PubChem CID
- 69426
- DTXSID
DTXSID20212209- UNII
- 0SGG217EFR
- EC Number
- 211-136-7
- Nikkaji
- J79.772C
물성
구조 계산 물성
- XLogP
- 4.3
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 0
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 8
- 형식 전하
- 0
- 복잡도
- 78
실험 및 물리화학적 성질
물리화학적 성질
- 녹는점
- 215 · 215-220 °C (dec.) (lit.)
- 끓는 점
- 219 ℃ · 219℃
- 밀도
- 2.713 g/mL · 2.713 g/mL at 25 °C (lit.)
- 굴절률
- 1.51 · 1.5100 (estimate)
- 인화점
- 105 ℃ · 105℃
- 저장 조건
- Keep in dark place,Sealed in dry,Room Temperature
- 물리적 상태
- 결정질 분말, 결정 및/또는 덩어리
- 색상
- 흰색에서 베이지색
- 수용성
- 물에 불용성.
- BRN
- 1699471 · 1699471
- 안정성
- 안정적인. 강한 산화제와 호환되지 않습니다.
- InChI
- InChI=1S/C2Br2Cl4/c3-1(5,6)2(4,7)8
- InChIKey
- WJUKOGPNGRUXMG-UHFFFAOYSA-N
- SMILES
- C(Br)(Cl)(Cl)C(Br)(Cl)Cl
화학적 성질
colourless solid
안전 및 규제
GHS 분류
GHS Classification
Warning
H302 (13.7%): Harmful if swallowed [Warning Acute toxicity, oral]
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)
Aggregated GHS information provided per 51 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
안전 데이터
- wgk
- 3
- rtecs
- KH9366000
- HS 번호
- 29037800
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-37/39
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
개요1, 2-dibromotetrachloroethane (DBTCE) is a commonly used and mild bromination reagent, suitable for the bromination reaction of alkenes. DBTCE can effectively inhibit the Wagner-Meerwein rearrangement reaction during the bromination process of bicyclic alkenes. In addition, DBTCE is also used to establish a room-temperature catalytic cycle to convert thiocarbonyl compounds into their oxygen analogues. Because DBTCE is relatively expensive, it has not been classified as an ozone-depleting substance.
용도1,2-dibromotetrachloroethane is used as a fire-proofing agent. It is actively involved in the conversion of sulfones to alkenes by Ramberg-Backlund rearrangement. It is an effective replacement for ozone depleting solvents like dibromodifluoromethane and tetrabromodifluoroethane. It is also utilized as a brominating reagent. In analytical chemistry, it is used in quantitative determination of perhalogenated compounds by high-performance liquid chromatography (HPLC).
일반 설명1,2-Dibromotetrachloroethane acts as halogenating reagent for the one-pot conversion of sulfones to alkenes by Ramberg-Bcklund rearrangement. It is a useful brominating reagent for diaryl TeII species.
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