2-iodopropane

• ChemBase编号: 89071
• 分子式: C3H7I
• 平均质量: 169.99215
• 单一同位素质量: 169.95924822
• SMILES: IC(C)C
• Canonical SMILES: CC(I)C
• InChI: InChI=1S/C3H7I/c1-3(2)4/h3H,1-2H3
• InChIKey: FMKOJHQHASLBPH-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 2-iodopropane
• IUPAC传统名: 2-iodopropane
• 别名: 异丙基碘; 2-碘丙烷; 2-Iodopropane; Isopropyl iodide; 2-Iodopropane; Isopropyl iodide; 2-IODOPROPANE; n-PROPYL IODIDE

登记号

• CAS号: 75-30-9; 107-08-4
• EC号: 203-460-2; 200-859-3
• MDL号: MFCD00001071
• Beilstein号: 1098244
• 默克索引号: 145214
• PubChem SID: 24881578; 24848923; 162075957
• PubChem CID: 6362
• Chemspider ID: 6122
• 医学主题词(MeSH): isopropyl+iodide
• 维基百科标题: Isopropyl_iodide

理论计算性质

• 质子受体: 0
• 质子供体: 0
• LogD (pH = 5.5): 2.1213927
• LogD (pH = 7.4): 2.1213927
• Log P: 2.1213927
• 摩尔折射率: 28.7611 cm^3
• 极化性: 11.389769 Å^3
• 极化表面积: 0.0 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: 1.4 g L^-1 (at 12.5 °C) in water; Miscible in benzene; Miscible in chloroform; Miscible in diethyl ether; Miscible in ethanol
• 外观: Colourless liquid
• 熔点: -90 °C(lit.); -90°C; -90.00°C (183.15K); -90°C
• 沸点: 88.75 - 89.75°C (361.9 - 362.9 K); 88-90 °C(lit.); 88-90°C; 88-90°C
• 闪点: 107.6 °F; 42 °C; 42°C; 42.2°C; 42°C(107°F)
• 密度: 1.701; 1.703; 1.703 g mL^-1; 1.703 g/mL at 25 °C(lit.); 1.703g/ml
• 折射率: 1.4982; 1.4997; n20/D 1.498; n20/D 1.498(lit.)
• 亨利常数: 890 nmol Pa^-1 kg^-1
• 粘度: 6.971 mPa (at 20 °C)
• 热容: 137.3 J K^-1 mol^-1
• 标准摩尔生成焓 (ΔfH^o298): -77.2–-72.6 kJ mol^-1

安全信息

• 保存条件: Room Temperature (15-30°C), Protect from light
• 保存注意事项: Flammable/Harmful/Air Sensitive/Light Sensitive/Store under Argon; Light Sensitive
• RTECS编号: TZ4100000; TZ4200000
• 欧盟危险性物质标志: 易燃性(Flammable) (F); 刺激性(Irritant) (Xi); 有害性(Harmful) (Xn)
• 联合国危险货物编号: 2392; UN2392
• 德国WGK号: 3
• 联合国危险货物等级: 3
• 联合国危险货物包装类别(PG): 3; III
• 澳大利亚Hazchem: 2Y
• 危险公开号: 10-22; 10-36/37/38; R:10; R10, R22
• 安全公开号: 26-37; 36/37; S:9-16-29; S36/37
• 欧盟危险货物分类: F1
• 欧盟危险识别号(EUHIN): 3B
• 美国ERG指导号: 129
• TSCA收录: 是
• GHS危险品标识: GHS exclamation mark; GHS flame; GHS02; GHS07
• GHS警示词: WARNING; Warning
• GHS危险声明: 226, 302; H226-H302; H226-H315-H319-H335
• GHS警示性声明: P280G-P305+P351+P338
• 个人保护装置: Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 2392 3/PG 3

产品相关信息

• 纯度: ≥97.0% (GC); 98+%, stab. with copper; 99%
• 级别: purum
• 其他组分: copper as stabilizer; silver wool as stabilizer
• 线性分子式: (CH3)2CHI

详细说明

MP Biomedicals - 02155067

(Isopropyl iodide) This item is stabilized with copper. 1 ml = approx. 1.70 g POSSIBLE CARCINOGEN!

Apollo Scientific Ltd - OR4540

Stabilised with copper

Sigma Aldrich - 148938

包装
5, 100, 500 g in glass bottle

参考文献

• The ring-opening of cyclic thionocarbonates followed by reductive elimination with zinc to give alkenes provides an alternative to the Corey-Winter desulfurization method (see Triethyl phosphite, L00339): Tetrahedron Lett., 3793 (1973).