비스(트리메틸알루미늄)-DABCO(R)부가물,DABAL-Me3,DABAL-트리메틸알루미늄,트리에틸렌디아민비스(트리메틸알루미늄)

1,4-Diazabicyclo(2.2.2)octane--trimethylalumane (1/2)

HCID 16688366CAS 137203-34-0

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: C1CN2CCN1CC2.[CH3][Al]([CH3])[CH3].[CH3][Al]([CH3])[CH3]
InChIKey: WSTAITCRSVOCTK-UHFFFAOYSA-N
분자식: C12H30Al2N2
평균 분자량: 256.34 g/mol
단동위원소 질량: 256.20397622

개요

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이름 및 식별자

우선 이름: 1,4-Diazabicyclo(2.2.2)octane--trimethylalumane (1/2)
IUPAC: 1,4-diazabicyclo[2.2.2]octane;bis(trimethylalumane)
현지명: 비스(트리메틸알루미늄)-DABCO(R)부가물,DABAL-Me3,DABAL-트리메틸알루미늄,트리에틸렌디아민비스(트리메틸알루미늄)
영어명: Bis(trimethylaluminum)-1,4-diazabicyclo[2.2.2]octane adduct
분자식: C12H24Al2N2
분자량: 250.3

이름 및 동의어

DTXSID205869171,4-Diazabicyclo(2.2.2)octane--trimethylalumane (1/2)1,4-Diazabicyclo[2.2.2]octane--trimethylalumane (1/2)RefChem:1053248DTXCID80537682137203-34-01,4-diazabicyclo[2.2.2]octane;trimethylalumaneDABAL-Me3SCHEMBL173954AKOS025294430Bis(trimethylaluminum)-DABCO(R) adduct, DABAL-Me3, DABAL-trimethylaluminum, Triethylenediaminine bis(trimethylaluminum)비스(트리메틸알루미늄)-DABCO(R)부가물,DABAL-Me3,DABAL-트리메틸알루미늄,트리에틸렌디아민비스(트리메틸알루미늄)

이름 더 보기

DABAL-trimethylaluminumBis(trimethylaluminum)-DABCO(R) adductTriethylenediaminine bis(trimethylaluminum)1,4-diazabicyclo[2.2.2]octane,trimethylalumaneDABAL-Me3 (adduct of trimethylaluminum and DABCO)is(trimethylaluminum)-1，4-diazabicyclo[2.2.2]octane adduct1,4-DIAZABICYLO[2.2.2]OCTANE BIS(TRIMETHYLALUMINUM) COMPLEX1,4-Diazabicyclo[2.2.2]Octane Bis(Trimethylaluminum) ComplexBis(trimethylaluminum)-1,4-diazabicyclo[2.2.2]octane adduct

데이터베이스 식별자

CAS: 137203-34-0
PubChem CID: 16688366
DTXSID: DTXSID20586917

물성

구조 계산 물성

극성 표면적: 6.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 16
형식 전하: 0
복잡도: 69.5

물리화학적 성질

녹는점: 250 °C · >250 °C
인화점: 23 °C · 23°C (73°F)
저장 조건: Hygroscopic, Room Temperature, Under inert atmosphere
용해도: 벤젠(약간 용해됨), DMSO(약간 용해됨)
물리적 상태: 고체
색상: 흰색에서 황백색까지
안정성: 흡습성, 수분에 민감하고 산성 수용액에서 불안정함
InChI: 1S/C6H12N2.6CH3.2Al/c1-2-8-5-3-7(1)4-6-8;;;;;;;;/h1-6H2;6*1H3;;
InChIKey: WSTAITCRSVOCTK-UHFFFAOYSA-N
SMILES: C[Al-](C)(C)[N+]12CC[N+](CC1)(CC2)[Al-](C)(C)C

안전 및 규제

안전 데이터

wgk: 3
ridadr: UN 3395 4.3/PG 1
risk_code: 14-15-22-36/37/38
hazard_code: F,Xn
safety_code: 16-26-43
Hazard Classifications: Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3Water-react 1
스토리지 클래스: 4.3 - Hazardous materials which set free flammable gases upon contact with water

화학 및 산업

응용 분야 · 2건

용도Bis(trimethylaluminum)-DABCO(R) adduct, DABAL-Me3, DABAL-trimethylaluminum, Triethylenediaminine bis(trimethylaluminum) is a non-pyrophoric alternative to trimethylaluminum for use in numerous reactions including methylations of aldehydes and imines, methylations of aryl and vinyl halides, conjugate addition to enones, and amide bond formation.1

일반 설명Product is air and moisture sensitive. Handle and store under a dry, inert atmosphere.