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기본 정보
- CAS
1148148-01-9- 표준 SMILES
COc1ccc(OC)c(P(C2CCCCC2)C2CCCCC2)c1-c1c(C(C)C)cc(C(C)C)cc1C(C)C.NCCc1[c-]cccc1.[Cl][Pd+]- InChIKey
IWMMXPNBCHCFCY-UHFFFAOYSA-M- 분자식
- C43H63ClNO2PPd
- 평균 분자량
- 798.8 g/mol
- 단동위원소 질량
- 797.33198
이름 및 식별자
- 우선 이름
- BrettPhos Palladacycle
- IUPAC
- chloropalladium(1+);dicyclohexyl-[3,6-dimethoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane;2-phenylethanamine
- 영어명
- BrettPhosPalladacycle
- 분자식
- C43H63ClNO2PPd
- 분자량
- 798.81
이름 및 동의어
1148148-01-9BrettPhos PalladacycleBrettPhos Pd G1MFCD12545956Chloro(2-(dicyclohexylphosphino)-3,6-dimethoxy-2',4',6'-triisopropyl-1,1'-biphenyl)(2-(2-aminoethyl)phenyl)palladium(II)Chloro[2-(dicyclohexylphosphino)-3,6-dimethoxy-2',4',6'-triisopropyl-1,1'-biphenyl][2-(2-aminoethyl)phenyl]palladium(II)C43H63ClNO2PPdChloro[2-(dicyclohexylphosphino)-3,6-dimethoxy-2',4',6'-triisopropyl-1,1'-biphenyl][2-(2-aminoethyl)phenyl]Pd(II)Dicyclohexyl(2',4',6'-triisopropyl-3,6-dimethoxy-[1,1'-biphenyl]-2-yl)phosphine-(2-(2-aminoethyl)phenyl)palladium(II) chlorideBrett Phos pre Pd catalystSCHEMBL17606838AKOS028109735
이름 더 보기
BrettPhos precatalystBrettPhos Pd G1 Methyl-t-Butyl Ether Adductdicyclohexyl-[3,6-dimethoxy-2-(2,4,6-triisopropylphenyl)phenyl]phosphaneBrettPhos Pd G1 MTBE adductBrettPhos Palladacycle Gen. 1chloro-(2-phenylethylamino)palladium[2-(2-aminoethyl)phenyl]palladium(1+)(II) Chloro[2-(dicyclohexylphosphino)-3
BP-21209Chloro[2-(dicyclohexylphosphino)-3,6-dimethoxy-2'-4'-6'-tri-i-propyl-1,1'-biphenyl][2-(2-minoethyl)O11708chloropalladium(1+);dicyclohexyl-[3,6-dimethoxy-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane;2-phenylethanamineCl-[2-(dicyclohexylphosphino)-3,6-diMeO-2',4',6'-tri-i-prop-1,1'-biPh][2-(2-aminoethyl)Ph]Pd(II)
데이터베이스 식별자
- CAS
1148148-01-9- PubChem CID
- 25112666
- EC Number
- 689-533-3
물성
구조 계산 물성보충 중
- 극성 표면적
- 44.5 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 49
- 형식 전하
- 0
- 복잡도
- 816
물리화학적 성질
- 녹는점
- 198 · 198-204 °C
- 저장 조건
- 2 · 2-8°C, protect from light, stored under nitrogen
- 물리적 상태
- 가루
- 색상
- 하얀색
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)
안전 데이터
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26
화학 및 산업
응용 분야
용도Application Guide for Palladium Catalyzed Cross-Coupling ReactionsCatalyst for:C,N-cross coupling of unprotected 3-halo-2-aminopyridines with primary and secondary aminesAmination reactionN-arylation of aminophenols
일반 설명BrettPhos Pd G1 is a Buchwald first generation (G1) palladacycle precatalyst that can be used in cross-coupling reactions for the formation of C-C, C–N, C–O, C–F, C–CF3, and C–S bonds. The formation of the active Pd(0) species in the G1 precatalyst is easy to generate, requiring merely a deprotonation with a base. The resulting catalyst is very active, even at temperatures down to 40 °C, and can be used in a variety of cross-coupling protocols.
공급사94 곳
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
上海摩睿化学科技有限公司13382110328 15255501563 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
新乡市润宇新材料科技有限公司15690792173 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
上海毕合生物化学技术有限公司13816464724 15900990114 · [email protected]
苏州启航生物科技有限公司18151111370 · [email protected]
武汉拓创达科技有限公司18627850571 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
武汉厚双科技有限公司13080686708; 13080686708 · [email protected]
上海药诚医药科技合伙企业（有限合伙）400-6181121 18616381138 · [email protected]
Wuhan Huahan Dingcheng New Material Technology Co., Ltd+undefined-027-81388558 +undefined086-1878077615 · [email protected]
Wuhan LPBchem Technology Co.,Ltd+86-027-63498399 15071314134 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
欧利希（湖北）医药科技有限公司17316404525 17316404525 · [email protected]
上海钰康生物科技有限公司+86-18930848214 +86-021-56762820 · [email protected]
江苏欣诺科催化剂股份有限公司0512-67216630 67216634 · [email protected]
嘉兴市艾森化工有限公司0573-85285100 18627885956 · [email protected]
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
南京辛西亚生物科技有限公司0550-5618439 15951861180 · [email protected]
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QINGDAO KAIENSI INTERNATIONAL TRADE CO.,LTD.+86-0532-8699-9256 +86-18518128472 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
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上海茵凯化学科技有限公司021-57603038 13601791340;13818007232 · [email protected]
上海默衡科技有限公司15001930925 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
陕西缔都医药化工有限公司+86-029-81138252 +86-173 9270 1263 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
Chongqing jooe co., ltd+86-15223382610 · [email protected]
上海兴鲁化工科技有限公司02120970332 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
武汉佳德瑞峰新材料有限公司18271874579 / 18971104330 18971104330 · [email protected]
南京政琦科技有限公司19853943728 19853943728 · [email protected]
上海皓之翔生物科技有限公司（原上海拓青化工有限公司）526763801 13301653310 · [email protected]
ZHENGZHOU JIUYI TIME NEW MATERIALS CO,.LTD+8613676922317 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466205 15377579727 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
嘉兴市德亿化工有限公司0573-85866609 13325730825 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
武汉多普乐生物医药有限公司+86-02787215551 19945035818 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
郑州金一化工科技有限公司0371-65511006 18625597674 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
小辣椒试剂021-60702684 18516024827 · [email protected]
杭州摩库生物医药科技有限公司400-711-5280 86-571-81025280 · [email protected]
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