sulfurooyl dichloride

• ChemBase编号: 129870
• 分子式: Cl2OS
• 平均质量: 118.9704
• 单一同位素质量: 117.90469098
• SMILES: ClS(=O)Cl
• Canonical SMILES: ClS(=O)Cl
• InChI: InChI=1S/Cl2OS/c1-4(2)3
• InChIKey: FYSNRJHAOHDILO-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: sulfurooyl dichloride
• IUPAC传统名: thionyl chloride
• 别名: 氯化亚砜; 亚硫酰氯 溶液; Thionyl chloride; Thionyl dichloride; Sulfurous oxychloride; Sulfinyl chloride; sulfinyl dichloride; Dichlorosulfoxide; Sulfur oxide dichloride; Sulfur monoxide dichloride; Sulfuryl(IV) chloride; Thionyl chloride; Thionyl chloride solution

登记号

• CAS号: 7719-09-7
• EC号: 231-748-8
• MDL号: MFCD00011449
• Beilstein号: 1209273
• PubChem SID: 24857637; 24853806; 162224156; 24859269; 24859270; 24868330
• PubChem CID: 24386
• CHEBI ID: 29290
• Chemspider ID: 22797
• 维基百科标题: Thionyl_chloride

理论计算性质

• 质子受体: 1
• 质子供体: 0
• LogD (pH = 5.5): 0.7949061
• LogD (pH = 7.4): 0.7949061
• Log P: 0.7949061
• 摩尔折射率: 19.4713 cm^3
• 极化性: 8.383097 Å^3
• 极化表面积: 17.07 Å^2
• 可自由旋转的化学键: 0
• 里宾斯基五规则: true

分子性质

理化性质

• 溶解度: exothermic reaction in water; soluble in benzene, chloroform, CCl₄
• 外观: APHA: ≤50; clear, colorless to yellow liquid with unpleasant odor
• 熔点: -104.5 °C; -105 °C(lit.)
• 沸点: 74.6 °C; 79 °C(lit.)
• 闪点: Non-flammable
• 密度: 1.373 g/mL at 25 °C; 1.631 g/mL at 25 °C(lit.); 1.638 g/cm^3, liquid; 1.64 g/mL at 20 °C
• 折射率: 1.517 (20 °C); n20/D 1.518(lit.)
• 蒸汽压: 97 mmHg ( 20 °C)
• 粘度: 0.6 cP

安全信息

• RTECS编号: XM5150000
• 欧盟危险性物质标志: 腐蚀性(Corrosive) (C)
• 联合国危险货物编号: 1836; 2922
• 德国WGK号: 1
• 联合国危险货物等级: 8
• 联合国危险货物包装类别(PG): 1; 2
• 危险公开号: 14-20/22-29-35; 20/21/22-34-40; R14, R20/22, R29, R35
• 安全公开号: 26-27-28.1-36/37/39-45; 26-36/37/39-45; S1/2, S26, S30, S36/37/39, S45
• 欧盟危险品索引: 016-015-00-0
• GHS危险品标识: GHS05; GHS06
• GHS警示词: Danger
• 主要危害: Water- and moisture- sensitive, reactive. ; Never add water to this product as the hydrolysis reaction with water is violent.
• NFPA704:
  

  0

  4

  2

  W
• GHS危险声明: H302-H314-H331
• GHS警示性声明: P261-P280-P305 + P351 + P338-P310
• 个人保护装置: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 1836 8/PG 1; UN 2922 8/PG 2
• 欧盟补充危害声明: Contact with water liberates toxic gas., Reacts violently with water.

产品相关信息

• 纯度: ≥90.0%; ≥95.0%; ≥98%; ≥99%; ≥99.0%; 97%; 99.5%
• 浓度: 2.0 M in methylene chloride
• 级别: puriss.; purum; reagent grade; ReagentPlus®; SAJ first grade; SAJ special grade; technical grade
• 其他组分: <5 ppm iron
• 线性分子式: SOCl2

详细说明

Sigma Aldrich - 447285

包装
1 L in glass bottle
100, 500 mL in glass bottle
5 mL in ampule
法律信息
ReagentPlus 注册商标 Sigma-Aldrich Co. LLC

Sigma Aldrich - 18438

General description
外观：无色或淡黄色澄清液体

Sigma Aldrich - 293121

包装
100, 800 mL in Sure/Seal™

Sigma Aldrich - 320544

包装
1, 2.5 L in PVC coated
法律信息
ReagentPlus 注册商标 Sigma-Aldrich Co. LLC

Sigma Aldrich - 320536

包装
1 L in glass bottle

Sigma Aldrich - 230464

包装
1, 2.5 L in glass bottle
5, 100 mL in glass bottle
法律信息
ReagentPlus 注册商标 Sigma-Aldrich Co. LLC