41479-14-5 ((Poly(oxy-1,2-ethanediyl),a,a'-(1,4-phenylenedicarbonyl)bis[w-hydroxy-)

CAS号:
41479-14-5
英文名称:
Poly(oxy-1,2-ethanediyl),a,a'-(1,4-phenylenedicarbonyl)bis[w-hydroxy-
分子式:
C12H14O6
分子量:
254.235964298248

Poly(oxy-1,2-ethanediyl),a,a'-(1,4-phenylenedicarbonyl)bis[w-hydroxy-(41479-14-5)名称与标识符

名称

中文别名:
对苯二甲酸双(2-羟乙基)酯;
英文别名:
bis(2-hydroxyethyl) benzene-1,4-dicarboxylate;SY057424;UNII-J61IL5R964;41479-14-5;HSDB 5775;1,4-Benzenedicarboxylic acid, 1,4-bis(2-hydroxyethyl) ester;Q865947;bishydroxyethylterephthalate;bis-hydroxylethyl terephthalate;ETHYLENE GLYCOL, TEREPHTHALATE (2:1);Bis(-hydroxyethyl) terephthalate;959-26-2;1,4-Benzenedicarboxylic acid, bis(2-hydroxyethyl) ester;Bis(beta-hydroxyethyl) terephthalate;Bis(ethylene glycol) terephthalate;bis(2-hydroxyethyl)benzene-1,4-dicarboxylate;TEREPHTHALIC ACID DIETHYLENE GLYCOL ESTER;B3429;C8X;terephthalic acid diglycol ester;BIS(2-HYDROXYETHYL) 1,4-BENZENEDICARBOXYLATE;Terephthalic Acid Bis(2-hydroxyethyl) Ester;Bis(hydroxyethyl) terephthalate;J61IL5R964;1,4-bis(hydroxyethyl) terephthalate;Bis(2-hydroxyethyl) terephthalate #;bis (2-hydroxyethyl) terephthalate;BIS(.BETA.-HYDROXYETHYL) TEREPHTHALATE [HSDB];bis-(beta-hydroxyethyl)-terephthalate;BS-49322;Bis(2-hydroxyethyl) Terephthalate (>80%);BHET; BHET(J); BHET-N;MFCD00081066;BHET;BIS(2-HYDROXYETHYL) TEREPHTHALATE;bis-(2-hydroxyethyl)-terephthalate;FT-0623012;NS00022907;TEREPHTHALICACIDBIS(2-HYDROXYETHYL)ESTER;bis-(2-hydroxyethyl) terephthalate;EINECS 213-497-6;DTXSID3052644;SCHEMBL26378;F71477;Terephthalic acid, bis(2-hydroxyethyl) ester;Bis(2-hydroxyethyl)terephthalate;

标识符

InChIKey:
QPKOBORKPHRBPS-UHFFFAOYSA-N
Inchi:
1S/C12H14O6/c13-5-7-17-11(15)9-1-2-10(4-3-9)12(16)18-8-6-14/h1-4,13-14H,5-8H2
SMILES:
O(CCO)C(C1C=CC(C(=O)OCCO)=CC=1)=O

Poly(oxy-1,2-ethanediyl),a,a'-(1,4-phenylenedicarbonyl)bis[w-hydroxy-(41479-14-5)物化性质

实验特性

  • LogP : -0.01520
  • PSA : 93.06000
  • 折射率 : 1.552
  • 沸点 : 446.5 °C at 760 mmHg
  • 熔点 : 106-109°C
  • 闪点 : 172 °C
  • 颜色与性状 : 白色至灰白色
  • 密度 : 1.315

计算特性

  • 精确分子量 : 254.079
  • 氢键供体数量 : 2
  • 氢键受体数量 : 6
  • 可旋转化学键数量 : 8
  • 同位素质量 : 254.079
  • 重原子数量 : 18
  • 复杂度 : 242
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 1.7
  • 拓扑分子极性表面积 : 93.1A^2

Poly(oxy-1,2-ethanediyl),a,a'-(1,4-phenylenedicarbonyl)bis[w-hydroxy-(41479-14-5)相关文献