compound introduction
另见:Alpha-cyano-m-hydroxycinnamic acid(注释已移至)。
CAS number:54673-07-3 molecular formula:C10H7NO3
另见:Alpha-cyano-m-hydroxycinnamic acid(注释已移至)。
| Chinese alias | α-氰基-3-羟基肉桂酸 | 2-氰基-3-(3-羟苯基)丙烯酸 | ||
| English alias | 2-Cyano-3-(3-hydroxyphenyl)acrylic Acid | 2-cyano-3-(3-hydroxyphenyl)-2-propenoic acid | 2-cyano-3-(3-hydroxyphenyl)prop-2-enoic acid | SPBio_001421 | Q27187518 | DivK1c_000765 | KBio2_001977 | Spectrum3_001505 | KBioGR_000705 | FT-0622131 | KBio3_002649 | ||
| CAS number | 54673-07-3 | molecular formula | C10H7NO3 |
| molecular weight | 189.17 | Exact mass | ≥98% |
| PSA | 81.3 | logp | 1.4 |
| CAS | 54673-07-3 |
| Wikidata | Q27187518 |
| PubChem CID | 2101 |
| PubChem Reference Collection SID | 505466338 |
| XLogP3 | XLogP3-AA: 1.4 |
| 复杂性 | 300 |
| Exact Mass | 189.042593085 |
| 形式电荷 | 0 |
| 重原子计数 | 14 |
| Molecular Weight | 189.17 |
| Monoisotopic Mass | 189.042593085 |
| 可旋转键计数 | 2 |
| 氢键供体计数 | 2 |
| 氢键受体计数 | 4 |
| 共价键单元计数 | 1 |
| 同位素原子计数 | 0 |
| 拓扑极性表面积 | 81.3 Ų |
| 定义键立体中心计数 | 0 |
| 定义原子立体中心计数 | 0 |
| 未定义键立体中心计数 | 1 |
| 未定义原子手性中心计数 | 0 |
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