HCID301541

2-(4-Bromophenyl)cyclopropanecarboxylic acid

2-(4-bromophenyl)cyclopropane-1-carboxylic acid

C10H9BrO2241.08 g/molCAS 6142-65-0

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: O=C(O)C1CC1c1ccc(Br)cc1
InChIKey: DPBUJVBXRABXRH-UHFFFAOYSA-N
分子式: C10H9BrO2
平均分子量: 241.08 g/mol
单同位素质量: 239.97859

COMPUTED

结构计算性质

已同步

XLogP: 2.3
极性表面积: 37.3 Å²
氢键供体: 1
氢键受体: 2
可旋转键: 2
重原子: 13
形式电荷: 0
复杂度: 209

ALIASES

名称与别名

共 38 条

2-(4-bromophenyl)cyclopropanecarboxylic acid77255-26-62-(4-bromophenyl)cyclopropane-1-carboxylic acidMFCD031962802-(4-BROMOPHENYL)CYCLOPROPANECARBOXYLICACIDChemDiv2_001621MLS000043500SCHEMBL455245CHEMBL1487919REGID_for_CID_301541DTXSID30976981DPBUJVBXRABXRH-UHFFFAOYSA-NHMS1373J15HMS2168I21HMS3320O07CDA25526NSC179404SBB084075AKOS004115409AKOS016042123

REACTIONS

参与反应

8 条

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

查看

uspto-grants-2014_10 · 10.6084/m9.figshare.5104873.v1 · US08853390B2

查看

Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

查看

Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

查看

uspto-grants-2007_07 · 10.6084/m9.figshare.5104873.v1 · US07238706B2

查看

uspto-grants-2007_07 · 10.6084/m9.figshare.5104873.v1 · US07238706B2

查看

uspto-grants-2008_03 · 10.6084/m9.figshare.5104873.v1 · US07342024B2

查看

uspto-grants-2008_03 · 10.6084/m9.figshare.5104873.v1 · US07342024B2

查看