1,10-dibutyl decanedioate

• ChemBase编号: 104612
• 分子式: C18H34O4
• 平均质量: 314.46016
• 单一同位素质量: 314.24570957
• SMILES: CCCCOC(=O)CCCCCCCCC(=O)OCCCC
• Canonical SMILES: CCCCOC(=O)CCCCCCCCC(=O)OCCCC
• InChI: InChI=1S/C18H34O4/c1-3-5-15-21-17(19)13-11-9-7-8-10-12-14-18(20)22-16-6-4-2/h3-16H2,1-2H3
• InChIKey: PYGXAGIECVVIOZ-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 1,10-dibutyl decanedioate
• IUPAC传统名: dibutyl sebacate; DBS
• 别名: 癸二酸二丁酯; 癸二酸二正丁酯; Di-n-butyl decanedioate; Di-n-butyl sebacate; Decanedioic Acid 1,10-Dibutyl Ester; Decanedioic Acid Dibutyl Ester; Bis(n-butyl) Sebacate; DBS; Di-n-Butyl Sebacate; Dibutyl Decanedioate; Ergoplast SDB; Kodaflex DBS; NSC 3893; PX 404; Polycizer DBS; Reomol DBS; Sebacic Acid Di-n-butyl Ester; Staflex DBS; Uniflex DBS; Dibutyl Sebacate; Dibutyl sebacate; Dibutyl sebacate; SEBACIC ACID DIBUTYL ESTER; Sebacic acid dibutyl ester

登记号

• CAS号: 109-43-3
• EC号: 203-672-5
• MDL号: MFCD00027218
• Beilstein号: 1798308
• PubChem SID: 24893909; 24888276; 24899536; 24888275; 162091611
• PubChem CID: 7986

理论计算性质

• 质子受体: 2
• 质子供体: 0
• LogD (pH = 5.5): 5.208515
• LogD (pH = 7.4): 5.208515
• Log P: 5.208515
• 摩尔折射率: 88.4284 cm^3
• 极化性: 35.41162 Å^3
• 极化表面积: 52.6 Å^2
• 可自由旋转的化学键: 17
• 里宾斯基五规则: false

分子性质

理化性质

• 溶解度: hexane, toluene, ethanol and acetone: soluble; water and propylene glycol: insoluble
• 熔点: -11°C
• 沸点: 178-179 °C/3 mmHg(lit.); 344-345°C
• 闪点: 178 °C; 178°C(352°F); 352.4 °F
• 密度: 0.936 g/mL at 25 °C(lit.); 0.94; 0.94 g/ml
• 折射率: 1.441; n20/D 1.441; n20/D 1.441(lit.)
• 蒸汽压: 3 mm Hg at 180 °C

安全信息

• 保存条件: Room Temperature (15-30°C)
• RTECS编号: VS1150000
• 欧盟危险性物质标志: 刺激性(Irritant) (Xi)
• 德国WGK号: 1
• 危险公开号: 36/37/38
• 安全公开号: 26-36
• TSCA收录: 是
• GHS危险品标识: GHS07
• GHS警示词: Warning
• GHS危险声明: H315-H319-H335
• GHS警示性声明: P261-P305 + P351 + P338
• 个人保护装置: Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

产品相关信息

• 纯度: >90%; ≥90%; ≥97.0%; ≥97.0% (GC); ≥98.0%; 94%
• 级别: SAJ first grade; Selectophore™; technical grade
• 线性分子式: [-(CH2)4CO2(CH2)3CH3]2

详细说明

MP Biomedicals - 02156592

Purity: >90%
1 ml = approx. 0.94 g

Sigma Aldrich - D49504

Application
增塑剂
包装
1 L in poly bottle
250 mL in poly bottle

Sigma Aldrich - 84840

包装
1 L in glass bottle
250 mL in glass bottle

Sigma Aldrich - 84838

General description
请访问我们的 传感器应用页面 以了解更多信息。
法律信息
Selectophore 商标 Sigma-Aldrich GmbH

Toronto Research Chemicals - D429525

Dibutyl sebacate (DBS) is a dibutyl ester of sebacic acid. Dibutyl sebacate can be used for plastics in use in the food packaging industry, in plastics used for medical devices, and for pharmaceutical applications. Dibutyl sebacate is also used as a desen

参考文献

• Eriksson, M., et al.: Plant Physiol., 132, 732 (2003)
• ,,Beuve, N., et al.: Plant Cell Environ., 27, 1035 (2003)