Di-mu-chlorobis[5-chloro-2-[(4-chlorophenyl)(hydroxyimino-kappaN)methyl]phenyl-kappaC]palladium dimer
기본 정보
- CAS
287410-78-0- 표준 SMILES
ON=C(c1[c-]cc(Cl)cc1)c1ccc(Cl)cc1.ON=C(c1[c-]cc(Cl)cc1)c1ccc(Cl)cc1.[ClH+][Pd][ClH+].[Pd]- InChIKey
QPUPWYGEQHWYOF-UHFFFAOYSA-N- 분자식
- C26H18Cl6N2O2Pd2
- 평균 분자량
- 816 g/mol
- 단동위원소 질량
- 811.7569
이름 및 식별자
- 우선 이름
- Di-mu-chlorobis[5-chloro-2-[(4-chlorophenyl)(hydroxyimino-kappaN)methyl]phenyl-kappaC]palladium dimer
- IUPAC
- bis(N-[(4-chlorobenzene-6-id-1-yl)-(4-chlorophenyl)methylidene]hydroxylamine);dichloroniopalladium;palladium
- 영어명
- Di-U-chlorobis[5-chloro-2-((4-chlorophe&
- 분자식
- C26H16Cl6N2O2Pd2
- 분자량
- 813.97
이름 및 동의어
287410-78-0Di-mu-chlorobis[5-chloro-2-[(4-chlorophenyl)(hydroxyimino-kappaN)methyl]phenyl-kappaC]palladium dimerDi-mu-chlorobis[5-chloro-2-[(4-chlorophenyl)(hydroxyimino)methyl]phenyl]palladium(II) DimerNájera Catalyst INajera Catalyst INájera Catalyst I, CAS 287410-78-0Di-U-chlorobis[5-chloro-2-((4-chlorophe&chloro-[5-chloro-2-[C-(4-chlorophenyl)-N-hydroxy-carbonimido...Di-μ-chlorobis[5-chloro-2-[(4-chlorophenyl)(hydroxyimino-κN)methyl]palladium(II)]Di-μ-chlorobis[5-chloro-2-[(4-chlorophenyl)(hydroxyiMino)Methyl]phenyl]palladiuM(II) DiMerPalladium, di-m-chlorobis[5-chloro-2-[(4-chlorophenyl)(hydroxyimino-kN)methyl]phenyl-kC]di-Di-mu-chlorobis[5-chloro-2-[(4-chlorophenyl)(hydroxyimino)methyl]phenyl]palladium(II)Dimer>
데이터베이스 식별자
- CAS
287410-78-0- PubChem CID
- 146158487
- EC Number
- 621-728-0
물성
구조 계산 물성
- 극성 표면적
- 65.2 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 38
- 형식 전하
- 0
- 복잡도
- 914
물리화학적 성질
- 녹는점
- 208 · 208-210 °C
- 물리적 상태
- powder to crystal
- 색상
- White to Amber
- InChI
- 1S/2C13H8Cl2NO.2ClH.2Pd/c2*14-11-5-1-9(2-6-11)13(16-17)10-3-7-12(15)8-4-10;;;;/h2*1-3,5-8,17H;2*1H;;/q;;;;2*+1/p-2/b2*16-13+;;;;
- InChIKey
- GIMFEGPTUHULMU-VAABLSLRSA-L
- SMILES
- O\N=C(/c1ccc(Cl)cc1)c2ccc(Cl)cc2[Pd]Cl.O\N=C(/c3ccc(Cl)cc3)c4ccc(Cl)cc4[Pd]Cl
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 4 (100%)
안전 데이터
- wgk
- 3
- HS 번호
- 2931.90.6000
- risk_code
- 20/21/22
- hazard_code
- Xn
- safety_code
- 36/37
- Hazard Classifications
- Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 Oral
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도Highly effective catalyst for multiple aryl vinylation via Heck coupling. Palladacycle catalyst employed in a variety of carbon-carbon bond forming reactions.
관련 반응
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