N,N,N',N'-Tetramethylazodicarboxamide (HCID 4278)

이름 및 식별자

우선 이름: N,N,N',N'-Tetramethylazodicarboxamide
IUPAC: 3-(dimethylcarbamoylimino)-1,1-dimethylurea
영어명: N,N,N',N'-Tetramethylazodicarboxamide
분자식: C6H12N4O2
분자량: 172.19

이름 및 동의어

10465-78-8N,N,N',N'-TetramethylazodicarboxamideDTXSID6040456CHEBI:48958RefChem:1090319DTXCID40204561,1'-azobis(N,N-dimethylformamide)N1,N1,N2,N2-Tetramethyldiazene-1,2-dicarboxamideMFCD000083181,1'-azobis(N,N'-dimethylformamide)(3E)-3-(dimethylcarbamoylimino)-1,1-dimethyl-ureaN,N,N',N'-Tetramethylazodicarboxamide(TMAD)

이름 더 보기

TMADDIAMIDE(E)-1-[(dimethylcarbamoyl)imino]-3,3-dimethylurea(E)-N1,N1,N2,N2-tetramethyldiazene-1,2-dicarboxamide3-(Dimethylcarbamoylimino)-1,1-dimethylureaNsc143013

C6H12N4O2TetramethylazodicarboxamideN,N',N'-TetramethylazodicarboxamideLopac0_000397SCHEMBL39340MLS002153343SCHEMBL103289orb1219154

데이터베이스 식별자

CAS: 10465-78-8
PubChem CID: 4278
DTXSID: DTXSID6040456
ChEMBL: CHEMBL1338900
EC Number: 233-951-7

물성

구조 계산 물성

XLogP: 0.2
극성 표면적: 65.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 12
형식 전하: 0
복잡도: 188

실험 및 물리화학적 성질

Chemical ClassesOther Uses -> Biochemical Research

Physical DescriptionYellow crystalline solid; [Sigma-Aldrich MSDS]

물리화학적 성질

녹는점: 112 °C · 112 °C
끓는 점: 220.4 · 220.4±23.0 °C(Predicted)
밀도: 1.13 · 1.13±0.1 g/cm3(Predicted)
저장 조건: -20 °C · -20°C
용해도: 메탄올에 용해됨
물리적 상태: 수정 같은
산도 계수 (pKa): 0 · -0+-.0.70(Predicted)
색상: 노란색
수용성: 19.6 · water: 19.60-21.00mg/mL, clear to slightly hazy, orange
BRN: 1910409 · 1910409
InChI: InChI=1S/C6H12N4O2/c1-9(2)5(11)7-8-6(12)10(3)4/h1-4H3/b8-7+
InChIKey: VLSDXINSOMDCBK-BQYQJAHWSA-N
SMILES: C(=O)(/N=N/C(=O)N(C)C)N(C)C

화학적 성질

Yellow crystals

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 50% (2 of 4) of reports.

Warning

H315 (50%): Causes skin irritation [Warning Skin corrosion/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 4 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationStatus: Active Update: 29-07-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/29433

Hazards SummaryMay cause irritation; [Sigma-Aldrich MSDS]

Hazard Classes and CategoriesSkin Irrit. 2 (50%)

안전 데이터

wgk: 3
rtecs: LQ1041000
HS 번호: 29270000
safety_code: 22-24/25
F 고인화성물질: 4.10
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

용도 및 제조

UsesA sulfhydryl reagent which oxidizes sulfhydryl groups to the disulfide form. It is a radiation-sensitizing agent of anoxic bacterial and mammalian cells. [ChemIDplus]

응용 분야 · 1건

용도Reported to be of use as a thiol oxidizing agent. Diamide has been used to titrate protein glutathiolation to discriminate from other oxidative protein modifications. Treatment increased protein glutathiolation in a concentration-dependent manner and had comparably little effect on protein-protein disulfide formation.