Di-tert-butyl diazene-1,2-dicarboxylate

HCID 6034084CAS 870-50-8

기본 정보

표준 SMILES
CC(C)(C)OC(=O)/N=N/C(=O)OC(C)(C)C
InChIKey
QKSQWQOAUQFORH-VAWYXSNFSA-N
분자식
C10H18N2O4
평균 분자량
230.26 g/mol

이름 및 식별자

우선 이름
Di-tert-butyl diazene-1,2-dicarboxylate
IUPAC
tert-butyl (NE)-N-[(2-methylpropan-2-yl)oxycarbonylimino]carbamate
영어명
Di-tert-Butyl azodicarboxylate
분자식
C10H18N2O4
분자량
230.26

이름 및 동의어

Di-tert-butyl diazene-1,2-dicarboxylateDi-tert-butylazodicarboxylate(E)-N-{[(tert-butoxy)carbonyl]imino}(tert-butoxy)formamide862421-89-4tert-butyl (NE)-N-[(2-methylpropan-2-yl)oxycarbonylimino]carbamateMFCD00015001N-{[(tert-butoxy)carbonyl]imino}(tert-butoxy)formamideEINECS 212-796-9NSC109889Di-tert-butyl azodiformatetert-butyl {[(tert-butyl)oxycarbonyl]diazenyl}formateDi-tert-butyl azodicarboxylate, 98%
이름 더 보기
di-tert-butyl (E)-diazene-1,2-dicarboxylateDI-T-BUTYL AZODICARBOXYLATEDi-tert-Butyl azodicSKL270DI-TERT-BUTYL AZODICARBOXYALTEDI-TERT-BUTYL AZODICARBOXYLATEBis(tert-butoxycarbonyl)diazene
SBB056423AKOS015838065Bis(1,1-dimethylethyl)azodicarboxylateCS-W010378GS-3460NSC 109889NSC-109889BP-11490

데이터베이스 식별자

CAS
870-50-8
PubChem CID
6034084
Nikkaji
J195.144K、J2.463.995I

물성

구조 계산 물성

XLogP
2.9
극성 표면적
77.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
4
무거운 원자 수
16

물리화학적 성질

녹는점
89 · 89-92 °C(lit.)
끓는 점
287.1 · 287.1±9.0 °C(Predicted)
밀도
1.06 · 1.06±0.1 g/cm3(Predicted)
저장 조건
2 · 2-8°C
용해도
클로로포름(소량으로 용해), 메탄올(약간 용해됨)
물리적 상태
결정 또는 결정성 분말

화학적 성질

yellow crystals or crystalline powder

안전 및 규제

안전 데이터

wgk
3
ridadr
1325
HS 번호
29270000
risk_code
36/37/38-11
hazard_code
Xi,F
safety_code
26-36-37/39-16

화학 및 산업

응용 분야 · 2건

용도Di-tert-butyl azodicarboxylate is a reagent used in the preparation of acyl hydrazinedicarboxylates. It is also used in the electrophilic amination of beta-keto esters catalyzed by an axially chiral guanidine. It serves as a precursor in an enantioselective synthesis of 3,6-dihyropyridazines employing organocatalysts such as L-proline or (S)-2-pyrrolidinyl tetrazole. It is also utilized in the asymmetric Friedel-Crafts amination through a chiral organocatalyst. Further, it acts as a reactant for preparation of hexapeptide key fragments through stereo selective selenocyclization/oxidative deselenylation reactions. In addition to this, it is employed as a starting material in the synthesis of pyrroloisoquinoline template through stereoselective N-acyliminium-mediated cyclization and enolate amination for preparation of peptidomimetic compounds and Barbier-type propargylation reactions.

일반 설명Di-tert-butyl azodicarboxylate is a an acid labile reagent for Mitsunobu reactions allowing facile isolation of products and for the electrophilic amination and hydrazination of enolates and lithium alkyls.

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]

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210건

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