1,1,1,3,3,3-hexafluoropropan-2-yl 2-methylprop-2-enoate

• ChemBase编号: 6511
• 分子式: C7H6F6O2
• 平均质量: 236.1117592
• 单一同位素质量: 236.02719875
• SMILES: O(C(C(F)(F)F)C(F)(F)F)C(=O)C(=C)C
• Canonical SMILES: O=C(C(=C)C)OC(C(F)(F)F)C(F)(F)F
• InChI: InChI=1S/C7H6F6O2/c1-3(2)4(14)15-5(6(8,9)10)7(11,12)13/h5H,1H2,2H3
• InChIKey: FMQPBWHSNCRVQJ-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 1,1,1,3,3,3-hexafluoropropan-2-yl 2-methylprop-2-enoate
• IUPAC传统名: 1,1,1,3,3,3-hexafluoropropan-2-yl 2-methylprop-2-enoate
• 别名: 1,1,1,3,3,3-六氟异丙基异丁烯酸酯; 1,1,1,3,3,3-Hexafluoroisopropyl methacrylate; HFiPMA; 1,1,1,3,3,3-Hexafluoroisopropyl methacrylate; 1,1,1,3,3,3-Hexafluoroprop-2-yl 2-methylprop-2-enoate; 2H-Perfluoroprop-2-yl methacrylate 99%; 1,1,1,3,3,3-Hexafluoro-2-propyl methacrylate; Methacrylic acid 1,1,1,3,3,3-hexafluoroisopropyl ester

登记号

• CAS号: 3063-94-3
• EC号: 221-309-9
• MDL号: MFCD00040105
• PubChem SID: 160969818; 24862785
• PubChem CID: 76469

理论计算性质

• Acid pKa: 15.017227
• 质子受体: 1
• 质子供体: 0
• LogD (pH = 5.5): 3.2776847
• LogD (pH = 7.4): 3.2776847
• Log P: 3.2776847
• 摩尔折射率: 36.988 cm^3
• 极化性: 13.767909 Å^3
• 极化表面积: 26.3 Å^2
• 可自由旋转的化学键: 5
• 里宾斯基五规则: true

分子性质

理化性质

• 沸点: 99°C; 99°C
• 闪点: 14 °C; 14°C; 14°C(57°F); 57.2 °F
• 密度: 1.302; 1.302 g/mL at 25 °C(lit.)
• 折射率: 1.331; 1.3310; n20/D 1.331(lit.)
• 蒸汽压: 0.71 psi ( 20 °C)

安全信息

• 保存注意事项: Highly Flammable/Harmful; IRRITANT, KEEP COLD
• 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: 3272; UN1993
• 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): 2; II
• 危险公开号: 11-20/21/22-36/37/38; 11-36/37/38
• 安全公开号: 16-26-33-36; 7-26-33-37-43-60
• TSCA收录: true; 是
• GHS危险品标识: GHS02; GHS07
• GHS警示词: Danger
• GHS危险声明: H224-H315-H319-H335; H225-H302-H312-H315-H319-H332-H335
• GHS警示性声明: P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A; P210-P261-P280-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 3272 3/PG 2

产品相关信息

• 纯度: 99%; 99%, stab.
• 线性分子式: H2C=C(CH3)CO2CH(CF3)2

详细说明

Apollo Scientific Ltd - PC4756

Affords low refractive index polymer.. Inhibited with 100-200 ppm MEHQ

Sigma Aldrich - 367664

包装
5 g in glass bottle