(2-((디메틸아미노)메틸)페닐)디페닐포스핀
1-(2-(Diphenylphosphanyl)phenyl)-N,N-dimethylmethanamine
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기본 정보
- CAS
53881-33-7- 표준 SMILES
CN(C)Cc1ccccc1P(c1ccccc1)c1ccccc1- InChIKey
POILNYUNIDNVDD-UHFFFAOYSA-N- 분자식
- C21H22NP
- 평균 분자량
- 319.4 g/mol
- 단동위원소 질량
- 319.1489867
이름 및 식별자
- 우선 이름
- 1-(2-(Diphenylphosphanyl)phenyl)-N,N-dimethylmethanamine
- IUPAC
- 1-(2-diphenylphosphanylphenyl)-N,N-dimethylmethanamine
- 현지명
- (2-((디메틸아미노)메틸)페닐)디페닐포스핀
- 영어명
- (2-((Dimethylamino)methyl)phenyl)diphenylphosphine
- 분자식
- C21H22NP
- 분자량
- 319.38
이름 및 동의어
53881-33-71-(2-(Diphenylphosphanyl)phenyl)-N,N-dimethylmethanamine(2-((Dimethylamino)methyl)phenyl)diphenylphosphinestarbld0006425SCHEMBL3665712POILNYUNIDNVDD-UHFFFAOYSA-NMFCD280535462-(diphenylphosphino)-N,N-dimethylbenzenemethanamine2-(Diphenylphosphino)-N,N-dimethylbenzylamine, 95%1-(2-diphenylphosphanylphenyl)-N,N-dimethylmethanamineN,N-dimethyl-[2-(diphenyl-phosphino)phenyl]methaneamine(2-((디메틸아미노)메틸)페닐)디페닐포스핀
이름 더 보기
2-(Diphenylphosphino)-N,N-dimethylbenzylamine2-(Diphenylphosphino)-N,N-dimethylbenzylamine 95%Benzenemethanamine, 2-(diphenylphosphino)-N,N-dimethyl-2-(Diphenylphosphino)-N,N-dimethylbenzylamine
데이터베이스 식별자
- CAS
53881-33-7- PubChem CID
- 11370610
- EC Number
- 803-965-3
- Nikkaji
- J1.062.039B
물성
구조 계산 물성보충 중
- XLogP
- 4.4
- 극성 표면적
- 3.2 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 23
- 형식 전하
- 0
- 복잡도
- 313
물리화학적 성질
- 녹는점
- 55 · 55-59°C
- 끓는 점
- 410.4 · 410.4±28.0 °C(Predicted)
- 산도 계수 (pKa)
- 8.62 · 8.62±0.28(Predicted)
- 물리적 상태
- liquid
- InChI
- 1S/C21H22NP/c1-22(2)17-18-11-9-10-16-21(18)23(19-12-5-3-6-13-19)20-14-7-4-8-15-20/h3-16H,17H2,1-2H3
- InChIKey
- POILNYUNIDNVDD-UHFFFAOYSA-N
- SMILES
- CN(C)CC1=C(C=CC=C1)P(C2=CC=CC=C2)C3=CC=CC=C3
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]；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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)
안전 데이터
- wgk
- 3
- risk_code
- 22-36/37/38
- hazard_code
- Xn
- safety_code
- 26-36/37/39
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도Phosphine ligand for cross coupling
관련 반응
3건
화합물 노트
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