HRID 1313384촉매로High-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
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기본 정보
- CAS
1805783-60-1- 표준 SMILES
CCCCc1c(F)c(F)c(-c2c(C(C)C)cc(C(C)C)c(-c3cccc(OC)c3P(C34CC5CC(CC(C5)C3)C4)C34CC5CC(CC(C5)C3)C4)c2C(C)C)c(F)c1F- InChIKey
ALWIRDZSIXWCBO-UHFFFAOYSA-N- 분자식
- C52H67F4OP
- 평균 분자량
- 815.1 g/mol
- 단동위원소 질량
- 814.4865664
이름 및 식별자
- 우선 이름
- AlPhos
- IUPAC
- bis(1-adamantyl)-[2-[3-(4-butyl-2,3,5,6-tetrafluorophenyl)-2,4,6-tri(propan-2-yl)phenyl]-6-methoxyphenyl]phosphane
- 영어명
- AlPhos
- 분자식
- C52H67F4OP
- 분자량
- 815.06
이름 및 동의어
AlPhos1805783-60-1AlPhos Pd G6 BrBis(1-adamantyl)-[2-[3-(4-butyl-2,3,5,6-tetrafluorophenyl)-2,4,6-tri(propan-2-yl)phenyl]-6-methoxyphenyl]phosphaneMFCD299050232097600-15-06-Methoxy-2-{2,4,6-tri-i-propyl-3-[(2,3,5,6-tetrafluoro-4-butyl )phenyl]phenyl}diadamantyl phosphine[4''-Butyl-2'',3'',5'',6''-tetrafluoro-3-methoxy-2',4',6'-tris(1-methylethyl)[1,1':3',1''-terphenyl]-2-yl]bis(tricyclo[3.3.1.1(3,7)]dec-1-yl)phosphinebis(adamantan-1-yl)({2-[4'-butyl-2',3',5',6'-tetrafluoro-2,4,6-tris(propan-2-yl)-[1,1'-biphenyl]-3-yl]-6-methoxyphenyl})phosphaneC52H67F4OPSCHEMBL31090692DTXSID001365631
이름 더 보기
6-Methoxy-2-{2,4,6-tri-i-propyl-3-[(2,3,5,6-tetrafluoro-4-butyl3',1''-terphenyl]-2-yl]bis(tricyclo[3.3.1.1(3,7)]dec-1-yl)phosphine6-Methoxy-2-{2,4,6-tri-i-propyl-3-[(2,3,5,6-tetrafluoro-4-butyl,AlPhos[4''-Butyl-2'',3'',5'',6''-tetrafluoro-3-methoxy-2',4',6'-tris(1-methylethyl)[1,1'6-Methoxy-2-{2,4,6-tripropyl-3-[(2,3,5,6-tetrafluorocyclopentyl)phenyl]phenyl}diphenylphosphine
물성
구조 계산 물성보충 중
- XLogP
- 15.7
- 극성 표면적
- 9.2 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 12
- 무거운 원자 수
- 58
- 형식 전하
- 0
- 복잡도
- 1,270
물리화학적 성질
- 녹는점
- 218 · 218-223 °C
- 저장 조건
- -20 °C · -20°C
- 물리적 상태
- 가루
- 색상
- 흰색에서 노란색으로
- InChIKey
- ALWIRDZSIXWCBO-UHFFFAOYSA-N
- SMILES
- P(C1=C(OC)C=CC=C1C1=C(C(C)C)C=C(C(C)C)C(C2=C(F)C(F)=C(CCCC)C(F)=C2F)=C1C(C)C)(C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- wgk
- WGK 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
일반 설명AlPhos is a versatile, highly efficient ligand used extensively in various important organic transformations. Recognized for its unique structure and attributes, AlPhos serves as an impressive catalyst that enables several key synthetic processes. It is primarily used in the following coupling reactions: Buchwald-Hartwig cross coupling, Suzuki-Miyaura coupling, Stille coupling, Sonogashira coupling, Negishi coupling, Heck coupling, Hiyama coupling reaction. With its remarkable performance across these reactions, AlPhos represents an invaluable tool in preparing and producing pharmaceuticals, agrochemicals, and polymers.
공급사34 곳
韶远科技(上海)有限公司4000665055 · [email protected]
新乡市润宇新材料科技有限公司15690792173 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Aladdin Scientific[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
Protheragen-ING+86-15618352007 · [email protected]
江苏欣诺科催化剂股份有限公司0512-67216630 67216634 · [email protected]
成都麦卡希化工有限公司
관련 반응
192건
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