록포스
(2',4'-Diisopropyl-3-methoxy-6-methyl-6'-propyl-2-biphenylyl)[bis(2-methyl-2-propanyl)]phosphine
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기본 정보
- CAS
1262046-34-3- 표준 SMILES
COc1ccc(C)c(-c2c(C(C)C)cc(C(C)C)cc2C(C)C)c1P(C(C)(C)C)C(C)(C)C- InChIKey
CVLLAKCGAFNZHJ-UHFFFAOYSA-N- 분자식
- C31H49OP
- 평균 분자량
- 468.7 g/mol
- 단동위원소 질량
- 468.35210318
이름 및 식별자
- 우선 이름
- (2',4'-Diisopropyl-3-methoxy-6-methyl-6'-propyl-2-biphenylyl)[bis(2-methyl-2-propanyl)]phosphine
- IUPAC
- ditert-butyl-[6-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane
- 현지명
- 록포스
- 영어명
- 2-(Di-t-butylphosphino)-3-methoxy-6-methyl-2',4',6'-tri-i-propyl-1,1'-biphenyl
- 분자식
- C31H49OP
- 분자량
- 468.69
이름 및 동의어
1262046-34-3(2',4'-Diisopropyl-3-methoxy-6-methyl-6'-propyl-2-biphenylyl)(bis(2-methyl-2-propanyl))phosphine(2',4'-Diisopropyl-3-methoxy-6-methyl-6'-propyl-2-biphenylyl)[bis(2-methyl-2-propanyl)]phosphineRefChem:394269805-149-2RockPhosDi-tert-butyl(2',4',6'-triisopropyl-3-methoxy-6-methyl-[1,1'-biphenyl]-2-yl)phosphineMFCD20922895RockpahosPhosphine, bis(1,1-dimethylethyl)[3-methoxy-6-methyl-2',4',6'-tris(1-methylethyl)[1,1'-biphenyl]-2-yl]-ditert-butyl-[6-methoxy-3-methyl-2-(2,4,6-triisopropylphenyl)phenyl]phosphaneditert-butyl-[6-methoxy-3-methyl-2-[2,4,6-tri(propan-2-yl)phenyl]phenyl]phosphane
이름 더 보기
록포스Di-tert-butyl(2′,4′,6′-triisopropyl-3-methoxy-6-methyl-[1,1′-biphenyl]-2-yl)phosphineRockPhos 97%Bis(1,1-dimethylethyl)[3-me2-Di-tert-butylphosphino-3-Methoxy-6-Methyl-2',4',6'-triisopro2-Dibutylphosphine-3-methoxy-6-methyl-2',4',6'-tripropylbiphenyl2-Di(tert-butyl)phosphino-2′,4′,6′-triisopropyl-3-methoxy-6-methylbiphenyl
2-Di-tert-butylphosphino-3-methoxy-6-methyl-2'-4'-6'-triisopropylbiphenyl2-Di-tert-butylphosphino-3-Methoxy-6-Methyl-2',4',6'-triisopropyl-1,1'-biphenylDi-tert-butyl(2',4',6'-triisopropyl-3-methoxy-6-methyl-2-biphenylyl)phosphine2-(Di-t-butylphosphino)-3-methoxy-6-methyl-2',4',6'-tri-i-propyl-1,1'-biphenylDi-tert-butyl(2',4',6'-triisopropyl-3-methoxy-6-methyl-[1,1'-biphenyl]-2-yl)phosphine;2-Di-tert-butylphosphino-3-Methoxy-6-Methyl-2',4',6'-triisopropyl-1,1'-biphenylRockPhos, 97%Di-tert-butyl(2 inverted exclamation marka,4 inverted exclamation marka,6 inverted exclamation marka-triisopropyl-3-methoxy-6-methyl-[1,1 inverted exclamation marka-biphenyl]-2-yl)phosphineC31H49OP
데이터베이스 식별자
- CAS
1262046-34-3- PubChem CID
- 56641709
- EC Number
- 805-149-2
- Nikkaji
- J3.022.647J
물성
구조 계산 물성보충 중
- XLogP
- 8.8
- 극성 표면적
- 9.2 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 33
- 형식 전하
- 0
- 복잡도
- 563
물리화학적 성질
- 녹는점
- 129 · 129-130°C
- 끓는 점
- 526.6 · 526.6±50.0 °C(Predicted)
- 저장 조건
- 15 · 15-25°C
- 물리적 상태
- 수정 같은
- 색상
- 하얀색
- InChI
- InChI=1S/C31H49OP/c1-19(2)23-17-24(20(3)4)28(25(18-23)21(5)6)27-22(7)15-16-26(32-14)29(27)33(30(8,9)10)31(11,12)13/h15-21H,1-14H3
- InChIKey
- CVLLAKCGAFNZHJ-UHFFFAOYSA-N
- SMILES
- P(C(C)(C)C)(C(C)(C)C)C1=C(OC)C=CC(C)=C1C1=C(C(C)C)C=C(C(C)C)C=C1C(C)C
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 (50%): 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 2 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%)
안전 데이터
- wgk
- 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도Rockpahos is commonly used as a catalyst in organic reactions along with a palladium compound catalyst.
관련 반응
557건
HRID 1301808촉매로High-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
HRID 1301809촉매로High-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
화합물 노트
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