2-[2-(1-cyano-1-methylethyl)diazen-1-yl]-2-methylpropanenitrile

• ChemBase编号: 126005
• 分子式: C8H12N4
• 平均质量: 164.20768
• 单一同位素质量: 164.1061964
• SMILES: CC(C)(C#N)/N=N/C(C)(C)C#N
• Canonical SMILES: N#CC(/N=N/C(C#N)(C)C)(C)C
• InChI: InChI=1S/C8H12N4/c1-7(2,5-9)11-12-8(3,4)6-10/h1-4H3
• InChIKey: OZAIFHULBGXAKX-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 2-[2-(1-cyano-1-methylethyl)diazen-1-yl]-2-methylpropanenitrile
• IUPAC传统名: azobisisobutyronitrile
• 别名: 2,2'-偶氮双(异丁腈); VAZO™ 催化剂 64 自由基源; 偶氮二异丁腈; 2,2′-Azobis(2-methylpropionitrile); 2,2'-偶氮双(异丁腈) 溶液; AIBN 溶液; 2,2'-偶氮二(2-甲基丙腈) 溶液; Free radical initiator; α,α′-Azoisobutyronitrile; 2,2′-Azobis(2-methylpropionitrile); Azobisisobutyronitrile; Azobisisobutylonitrile; AIBN; Azobisisobutyronitrile; α,α,′-Azoisobutyronitrile solution; AIBN solution; 2,2′-Azobis(2-methylpropionitrile) solution

登记号

• CAS号: 78-67-1
• EC号: 201-132-3
• MDL号: MFCD00013808
• Beilstein号: 1708400
• PubChem SID: 24847282; 162220348; 24867330
• PubChem CID: 6547
• Chemspider ID: 6299
• 维基百科标题: Azobisisobutyronitrile

理论计算性质

• 质子受体: 4
• 质子供体: 0
• LogD (pH = 5.5): 1.270368
• LogD (pH = 7.4): 1.270368
• Log P: 1.270368
• 摩尔折射率: 45.3356 cm^3
• 极化性: 16.86826 Å^3
• 极化表面积: 72.3 Å^2
• 可自由旋转的化学键: 2
• 里宾斯基五规则: true

分子性质

理化性质

• 外观: white crystals
• 熔点: 102-104 °C (dec.)(lit.); 103 - 105°C
• 闪点: 39.2 °F; 4 °C
• 密度: 0.858 g/mL at 25 °C; 1.1 g cm^-3
• 折射率: n20/D 1.495

安全信息

• RTECS编号: UG0800000
• 欧盟危险性物质标志: 爆炸性(Explosive) (E); 易燃性(Flammable) (F); 有害性(Harmful) (Xn)
• 联合国危险货物编号: 1294; 3234
• 德国WGK号: 2
• 联合国危险货物等级: 3; 4.1
• 联合国危险货物包装类别(PG): 2
• 危险公开号: 2-11-20/22-52/53; 63-11-38-48/20-65-67; R11, R25, R37/38, R41
• 安全公开号: 16-36/37-62; 39-41-47-61
• GHS危险品标识: GHS02; GHS07; GHS08
• GHS警示词: Danger
• GHS危险声明: H225-H304-H315-H336-H361d-H373; H242-H302 + H332-H412; H242-H302-H332-H412
• GHS警示性声明: P210-P261-P281-P301 + P310-P331; P273
• 个人保护装置: dust mask type N95 (US), Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges; Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges; Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 1294 3/PG 2; UN 3234 4.1
• 保存温度: 2-8°C

产品相关信息

• 纯度: ≥98.0%; ≥98.0% (GC); 98%
• 浓度: 0.2 M in toluene
• 级别: purum; SAJ first grade
• 燃烧残渣: ≤0.1%
• 杂质: ≤2% water
• 线性分子式: (CH3)2C(CN)N=NC(CH3)2CN
• Empirical Formula (Hill Notation): C8H12N4

详细说明

Sigma Aldrich - 714887

包装
100 mL in Sure/Seal™

Sigma Aldrich - 441090

Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
Application
自由基引发剂1
包装
25, 100 g in poly bottle
法律信息
VAZO 商标 E. I. du Pont de Nemours and Company

Sigma Aldrich - 11630

General description
自由基引发剂
Other Notes
可能实行销售限制
法律信息
VAZO 商标 E. I. du Pont de Nemours and Company

Sigma Aldrich - 01-7220

法律信息
VAZO 商标 E. I. du Pont de Nemours and Company