HCID3043883

2H-Thieno(2,3-c)(1)benzopyran-9-ol, 1,4-dihydro-7-(1,2-dimethylheptyl)-2,4,4-trimethyl-

2,4,4-trimethyl-7-(3-methyloctan-2-yl)-1,2-dihydrothieno[2,3-c]chromen-9-ol

C23H34O2S374.6 g/molCAS 56291-44-2

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准SMILES: CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)S1
InChIKey: HDPKJWICBWVRGV-UHFFFAOYSA-N
分子式: C23H34O2S
平均分子量: 374.6 g/mol
单同位素质量: 374.2279515

COMPUTED

结构计算性质

已同步

XLogP: 6.8
极性表面积: 54.8 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 6
重原子: 26
形式电荷: 0
复杂度: 526

ALIASES

名称与别名

共 12 条

BRN 13264821,2-Dihydro-7-(1,2-dimethylheptyl)-2,4,4-trimethyl-9-hydroxy-4H-thieno(2,3-c)(1)benzopyran56291-44-21,4-Dihydro-7-(1,2-dimethylheptyl)-2,4,4-trimethyl-2H-thieno(2,3-c)(1)benzopyran-9-ol2H-Thieno(2,3-c)(1)benzopyran-9-ol, 1,4-dihydro-7-(1,2-dimethylheptyl)-2,4,4-trimethyl-RefChem:269263CHEMBL3276133SCHEMBL11794288DTXSID20971728HDPKJWICBWVRGV-UHFFFAOYSA-N2,4,4-Trimethyl-7-(3-methyloctan-2-yl)-1,4-dihydro-2H-thieno[2,3-c][1]benzopyran-9-ol1,2-Dihydro-2,4,4-trimethyl-9-hydroxy-7-(3-methyl-2-octyl)-4H-thieno-[2,3-c][1]benzopyran

REACTIONS

参与反应

3 条

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

查看

uspto-grants-1976_06 · 10.6084/m9.figshare.5104873.v1 · US03960871

查看

uspto-grants-1976_06 · 10.6084/m9.figshare.5104873.v1 · US03960871

查看