기본 정보
- 표준 SMILES
CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21.[Cl][Pd][Cl]- InChIKey
HEYONDYPXIUDCK-UHFFFAOYSA-L- 분자식
- C39H32Cl2OP2Pd
- 평균 분자량
- 755.9 g/mol
이름 및 식별자
- 우선 이름
- Dichloro-(4,5-bis(diphenylphosphino)-9,9-dimethylxanthene)palladium(II)
- IUPAC
- dichloropalladium;(5-diphenylphosphanyl-9,9-dimethylxanthen-4-yl)-diphenylphosphane
- 현지명
- 디클로로 [9,9- 디메틸 -4,5- 비스 (디 페닐 포스 피노) 크 산텐] 팔라듐 (II)
- 영어명
- Dichloro[9,9-dimethyl-4,5-bis(diphenylphosphino)xanthene]palladium(II), min. 98%
- 분자식
- C39H34Cl2OP2Pd
- 분자량
- 757.97
이름 및 동의어
205319-10-4RefChem:586712Dichloro-(4,5-bis(diphenylphosphino)-9,9-dimethylxanthene)palladium(II)685-312-0DICHLORO[9,9-DIMETHYL-4,5-BIS(DIPHENYLPHOSPHINO)XANTHENE]PALLADIUM(II)dichloropalladium;(5-diphenylphosphanyl-9,9-dimethylxanthen-4-yl)-diphenylphosphane[4,5-Bis(diphenylphosphino)-9,9-dimethylxanthene]dichloropalladium(II)PdCl2(Xant-Phos)Dichloro[9,9-dimethyl-4,5- bis(diphenylphosphino)xanthene]palladium(II)FP973NGT7QSCHEMBL12466735SCHEMBL29721416
이름 더 보기
디클로로[9,9-디메틸-4,5-비스(디페닐포스피노)크산텐]팔라듐(II)Pd(XantPhos)Cl2Dichloro[9,9-diMethyl-4,5-bis(diphenylphosphino)xantheneDichloro[9PdCl2.XantPhosoro[9,9-dimethyL-4,5-bis(diphenyLphosphino)xanthene]paLDichloro[9,9-diMethyl-4,5-bis(bis(diphenylphosphino)xanthene]palladiuM(II)
SCHEMBL31581392AKOS024462646FD60980F10280[4,5-Bis(diphenylphosphino)-9,9-dimethylxanthene]palladium(II ) DichlorideDichloro[9,9-dimethyl-4,5-bis(diphenylphosphino)xanthene]palladium(II), 95%(SP-4-2)-Dichloro[1,1'-(9,9-dimethyl-9H-xanthene-4,5-diyl)bis[1,1-diphenylphosphine-kappaP]]palladium
데이터베이스 식별자
- CAS
205319-10-4- PubChem CID
- 60153068
- UNII
- FP973NGT7Q
- EC Number
- 685-312-0
물성
구조 계산 물성
- 극성 표면적
- 9.2 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 45
- 형식 전하
- 0
- 복잡도
- 734
물리화학적 성질
- 녹는점
- 280 · 280-287℃
- 저장 조건
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- 물리적 상태
- 결정질 고체
- 색상
- 노란색
- InChIKey
- HEYONDYPXIUDCK-UHFFFAOYSA-L
- SMILES
- [Cl-][Pd+2]1(P(C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=C3C(C)(C)C4=CC=CC(=C4OC=23)P1(C1C=CC=CC=1)C1C=CC=CC=1)[Cl-]
안전 및 규제
GHS 분류
GHS Classification
Danger
H228 (84.6%): Flammable solid [Danger Flammable solids]
P210, P240, P241, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 26 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesFlam. Sol. 1 (84.6%)
안전 데이터
- wgk
- 3
- tsca
- No
- HS 번호
- 2932.99.7000
- risk_code
- 43
- safety_code
- 24-37-60
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도Effective catalyst for carbonylation of aryl halides
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