1,2-diethylhydrazine dihydrochloride

• ChemBase编号: 149280
• 分子式: C4H14Cl2N2
• 平均质量: 161.07336
• 单一同位素质量: 160.05340382
• SMILES: CCNNCC.Cl.Cl
• Canonical SMILES: CCNNCC.Cl.Cl
• InChI: InChI=1S/C4H12N2.2ClH/c1-3-5-6-4-2;;/h5-6H,3-4H2,1-2H3;2*1H
• InChIKey: NMTDWUVFGOBBAX-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 1,2-diethylhydrazine dihydrochloride
• IUPAC传统名: N,N'-diethylhydrazine dihydrochloride
• 别名: 1，2-二乙基肼 二盐酸盐; N,N'-二乙基肼二盐酸盐; 1,2-Diethylhydrazine dihydrochloride; N,N'-Diethylhydrazine dihydrochloride

登记号

• CAS号: 7699-31-2
• MDL号: MFCD00012523
• Beilstein号: 3668380
• PubChem SID: 24853733; 162243448
• PubChem CID: 24372

理论计算性质

• 质子受体: 2
• 质子供体: 2
• LogD (pH = 5.5): -0.773574
• LogD (pH = 7.4): 0.09094269
• Log P: 0.1271777
• 摩尔折射率: 48.7204 cm^3
• 极化性: 10.95869 Å^3
• 极化表面积: 24.06 Å^2
• 可自由旋转的化学键: 3
• 里宾斯基五规则: true

分子性质

理化性质

• 熔点: 169 °C (dec.)(lit.); ca 169°C dec.

安全信息

• RTECS编号: MV2295000
• 欧盟危险性物质标志: 有毒(Toxic) (T); X
• 德国WGK号: 3
• 危险公开号: 21/22-36/37/38; 45-20/21/22-36/37/38
• 安全公开号: 26-36/37; 53-26-36/37/39-45
• TSCA收录: 否
• GHS危险品标识: GHS06; GHS07; GHS08
• GHS警示词: Danger
• GHS危险声明: H301-H311-H315-H319-H335; H302-H312-H315-H319-H332-H335-H350
• GHS警示性声明: P201-P261-P280-P305 + P351 + P338-P308 + P313; P261-P301+P310-P305+P351+P338-P361-P405-P501A
• 个人保护装置: Eyeshields, Gloves, type P2 (EN 143) respirator cartridges

产品相关信息

• 纯度: tech. 90%
• 线性分子式: C2H5NHNHC2H5 · 2HCl

详细说明

Sigma Aldrich - 229172

包装
5 g in glass bottle
Application
Reactant involved in:
• Bromopyridazinedione-mediated protein and peptide bioconjugation1
• Synthesis of human neutrophil proteinase 3 inhibitors2
• Three-component cascade processes for sythesis of aminoisoindolones and phthalazones3
• Stereoselective heterocyclization for synthesis of substituted hexahydropyrazolodiazepinecarboxylates4
• Synthesis of azacycloalkanes, isoindoles, pyrazole, pyrazolidine, and phthalazine derivatives5