HRID 1308688촉매로High-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
기본 정보
- CAS
93713-30-5- 표준 SMILES
CNc1ccc2ccccc2c1-c1c(NC)ccc2ccccc12- InChIKey
PXDKDUXMEHPNCO-UHFFFAOYSA-N- 분자식
- C22H20N2
- 평균 분자량
- 312.4 g/mol
- 단동위원소 질량
- 312.16264865
이름 및 식별자
- 우선 이름
- (S)-N,N'-Dimethyl-1,1'-binaphthyldiamine
- IUPAC
- N-methyl-1-[2-(methylamino)naphthalen-1-yl]naphthalen-2-amine
- 현지명
- (R)-N,Nμ-디메틸-2,2μ-디아미노-1,1μ-비나프틸,(R)-N,Nμ-디메틸-1,1μ-비나프탈렌-2,2μ-디아민
- 영어명
- (R)-N,Nμ-Dimethyl-2,2μ-diamino-1,1μ-binaphthyl, (R)-N,Nμ-Dimethyl-1,1μ-binaphthalene-2,2μ-diamine
- 분자식
- C22H20N2
- 분자량
- 312.41
이름 및 동의어
93713-30-5(S)-N,N'-DIMETHYL-1,1'-BINAPHTHYLDIAMINERefChem:408161635-656-293621-64-8N2,N2'-DIMETHYL-[1,1'-BINAPHTHALENE]-2,2'-DIAMINE666175-40-2(R)-N,N'-Dimethyl-1,1'-binaphthyldiamineN,N'-Dimethyl-2,2'-diamino-1,1'-binaphthyl(S)-N2,N2'-Dimethyl-[1,1'-binaphthalene]-2,2'-diamine(R)-N2,N2'-dimethyl-[1,1'-binaphthalene]-2,2'-diamineMFCD10566977
이름 더 보기
(R)-N,Nμ-디메틸-2,2μ-디아미노-1,1μ-비나프틸,(R)-N,Nμ-디메틸-1,1μ-비나프탈렌-2,2μ-디아민(R)-[1,1'-Binaphthalene]-2,2'-diamine, N,N'-dimethyl(R)-N,N′-Dimethyl-1,1′-binaphthyldiamine, CAS 93713-30-51,1'-Binaphthalene]-2,2'-diamine,N2,N2'-dimethyl-, (1R)-(R)-N,Nμ-Dimethyl-2,2μ-diamino-1,1μ-biphthyl, (R)-N,Nμ-Dimethyl-1,1μ-biphthalene-2,2μ-diamine(R)-N,Nμ-Dimethyl-2,2μ-diamino-1,1μ-binaphthyl, (R)-N,Nμ-Dimethyl-1,1μ-binaphthalene-2,2μ-diamine
N-methyl-1-[2-(methylamino)naphthalen-1-yl]naphthalen-2-amine[1,1'-Binaphthalene]-2,2'-diamine, N,N'-dimethyl(+/-) -rac-N,N'-Dimethyl-1,1'-binaphthyldiamine2,2'-Di(methylamino)-1,1'-binaphthalene(R)-2,2'-Di(methylamino)-1,1'-binaphthaleneSCHEMBL12787291(1R)-N,N'-Dimethyl-[1,1'-binaphthalene]-2,2'-diamine[1,1'-Binaphthalene]-2,2'-diamine, N2,N2'-dimethyl-
물성
구조 계산 물성
- XLogP
- 6
- 극성 표면적
- 24.1 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 24
- 형식 전하
- 0
- 복잡도
- 371
물리화학적 성질
- 끓는 점
- 516.1 · 516.1±45.0 °C(Predicted)
- 밀도
- 1.193 · 1.193±0.06 g/cm3(Predicted)
- 저장 조건
- 2 · Keep in dark place,Inert atmosphere,2-8°C
- 산도 계수 (pKa)
- 4.89 · 4.89±0.40(Predicted)
- BRN
- 5588762 · 5588762
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]
P261, P264, P264+P265, P271, P273, 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.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
안전 데이터
- wgk
- 3
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26
화학 및 산업
공급사41 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]
河南赢创生物科技有限公司16650615803 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
成都添福瑞生物科技有限公司18030648795 18030648795 · [email protected]
广东云星生物技术有限公司0751-18902340975/189023400307 18902340307 · [email protected]
北京绿百草科技发展有限公司010-61136123 · [email protected]
郑州研德生物科技有限公司0371-63682289 15538176268 · [email protected]
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
大赛璐药物手性技术（上海）有限公司021-50460086-9 15921403865 · [email protected]
河南多贝化工有限公司0370-2785118 17550508557 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
관련 반응
192건
HRID 1308689촉매로High-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
HRID 1308690촉매로High-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
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HRID 1308692촉매로High-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
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HRID 1308694촉매로High-throughput exploration of 50,688 Pd-, Ni- and Cu-catalysed C–N coupling reactions
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