HRID128228
uspto-grants-1981_03
作为反应物
uspto-grants-1981_03 · 10.6084/m9.figshare.5104873.v1 · US04259339
查看条件与参与物IDENTITY
结构与身份
- 标准 SMILES
- N#CCc1cccc(Oc2ccccc2)c1
- InChIKey
- DKGMALJGFUHPGB-UHFFFAOYSA-N
- 分子式
- C14H11NO
- 平均分子量
- 209.24 g/mol
- 单同位素质量
- 209.08406397
COMPUTED
结构计算性质
- XLogP
- 3
- 极性表面积
- 33 Ų
- 氢键供体
- 0
- 氢键受体
- 2
- 可旋转键
- 3
- 重原子
- 16
- 形式电荷
- 0
- 复杂度
- 249
物化、安全与法规信息正在同步。
ALIASES
名称与别名
51632-29-23-Phenoxybenzyl cyanidem-Phenoxybenzyl cyanide(3-Phenoxyphenyl)acetonitrile3-PhenoxybenzeneacetonitrileBenzeneacetonitrile, 3-phenoxy-(m-Phenoxyphenyl)acetonitrileACETONITRILE, (m-PHENOXYPHENYL)-88VMT2O2DVBRN 2106883UNII-88VMT2O2DVDTXSID20199581RefChem:154886DTXCID80122072DKGMALJGFUHPGB-UHFFFAOYSA-N3-Phenoxyphenylacetonitrile2-(3-phenoxyphenyl)acetonitrileMFCD000163932-(3-phenoxyphenyl)ethanenitrilem-phenoxy-benzyl cyanide
REACTIONS
参与反应
HRID276148
uspto-grants-2002_03
作为反应物
uspto-grants-2002_03 · 10.6084/m9.figshare.5104873.v1 · US06353128B1
查看条件与参与物HRID584353
uspto-grants-2005_08
作为反应物
uspto-grants-2005_08 · 10.6084/m9.figshare.5104873.v1 · US06924300B2
查看条件与参与物HRID834718
Test data from https://doi.org/10.1039/C8SC04228D
作为反应物
Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
查看条件与参与物HRID961663
Validation data from https://doi.org/10.1039/C8SC04228D
作为反应物
Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
查看条件与参与物HRID1070038
uspto-grants-2001_06
作为反应物
uspto-grants-2001_06 · 10.6084/m9.figshare.5104873.v1 · US06251926B1
查看条件与参与物HRID1115554
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D
查看条件与参与物HRID1137135
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D
查看条件与参与物