120659-38-3 ((Octanoic acid,3-hydroxy-, homopolymer)

快速询单

结构式：

Octanoic acid,3-hydroxy-, homopolymerMOL文件

CAS号：

120659-38-3

英文名称：

Octanoic acid,3-hydroxy-, homopolymer

分子式：

C₈H₁₆O₃

分子量：

160.210843086243

Octanoic acid,3-hydroxy-, homopolymer(120659-38-3)名称与标识符

名称

英文别名：

Octanoic acid,3-hydroxy-, homopolymer;poly(3-hydroxyoctanoic acid);3-hydroxyoctanoic acid;3-Hydroxyoctanoic acid homopolymer;Poly-3-hydroxyoctanoate;3-OH octanoic acid;3-hydroxy-octanoic acid;3-HYDROXYOCTANOICACID;C20793;AKOS011680663;F87768;56D53B3D-0070-413F-9F5E-C9D4528A9786;CHEBI:37098;beta-hydroxycaprylic acid;.BETA.-HYDROXYOCTANOIC ACID;(+/-)-3-Hydroxyoctanoic acid, >=97%;3-hydroxycaprylic acid;DL-beta-Hydroxycaprylic acid;EN300-79364;Z982131990;3-hydroxy caprylic acid;LMFA01050021;120659-38-3;Octanoic acid, 3-hydroxy-;14292-27-4;FT-0669988;3-OH-caprylic acid;SCHEMBL112858;beta-OH-caprylic acid;FT-0692189;(+/-)-3-Hydroxyoctanoic acid;3HO;3-HYDROXYOCTANOIC ACID, (+/-)-;Q15410154;UNII-8M44B02CSJ;3-Hydroxyoctanoate;Octanoic acid,3-hydroxy-;beta-OH-octanoic acid;CS-0059460;8M44B02CSJ;beta-hydroxyoctanoic acid;PD077430;HY-113058;DTXSID00864487;MFCD00133277;88930-08-9;TS-10038;

标识符

InChIKey：

NDPLAKGOSZHTPH-UHFFFAOYSA-N

Inchi：

1S/C8H16O3/c1-2-3-4-5-7(9)6-8(10)11/h7,9H,2-6H2,1H3,(H,10,11)

SMILES：

OC(CC(=O)O)CCCCC

Octanoic acid,3-hydroxy-, homopolymer(120659-38-3)物化性质

实验特性

PSA : 57.53

计算特性

精确分子量 : 160.10998
氢键供体数量 : 2
氢键受体数量 : 3
可旋转化学键数量 : 6
同位素质量 : 160.109944368g/mol
重原子数量 : 11
复杂度 : 112
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 : 1
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） : 1.4
拓扑分子极性表面积 : 57.5Å²

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