CAS number：86-29-3 molecular formula：C14H11N
不溶于水，溶于热醇、丙二醇、热挥发油和醚；微溶于冷挥发油。用作有机合成中间体。在医药方面用来生产胃胺、苯乙哌啶、类散痛等药物 Diphenylacetonitrile can be prepared in good yield by the dehydration of the amide of diphenyl acetic acid with phosphorous oxychloride. Diphenylacetonitrile undergoes anhydrous condensation with ethyl-4-bromo-butyrate. This is followed by its hydrolysis in alkaline medium that is used in the quantitative determination of 3-cyano-3,3-diphenylpropionic acid.
| Chinese alias | α-氰基二苯甲烷 | ||
| English alias | alpha-Cyanodiphenylmethane | Difenylacetonitril | PD065563 | FT-0667650 | USAF KF-13 | AKOS000120009 | Benzeneacetonitrile, .alpha.-phenyl- | Difenylacetonitril [Czech] | Diphenyl acetonitrile | AM90235 | Benzeneacetonitrile, alpha-phenyl- | BRD-K12971880 | ||
| CAS number | 86-29-3 | molecular formula | C14H11N |
| molecular weight | 193.24 | Exact mass | ≥99% |
| PSA | 23.8 | logp | 3.2 |
| CAS | 86-29-3 |
| UNII | QK4W106TKU |
| Wikidata | Q27287309 |
| ChEMBL ID | CHEMBL3185477 |
| Wikipedia | Diphenylacetonitrile |
| NSC Number | NSC Number: NSC884 |
| AIDS 编号 | 018366 |
| PubChem CID | 6837 |
| Nikkaji Number | J4.937I |
| DSSTox Substance ID | DTXSID4020539 |
| European Community (EC) Number | 201-662-5 |
| PubChem Reference Collection SID | 505584613 |
| XLogP3 | 3.2 |
| 复杂性 | 207 |
| 蒸气压 | 0.000102 [mmHg] |
| Exact Mass | 193.089149355 |
| 化学类别 | 氮化合物 -> 腈类 |
| 形式电荷 | 0 |
| 物理描述 | 奶油色或白色固体；[Alfa Aesar MSDS] |
| 重原子计数 | 15 |
| Molecular Weight | 193.24 |
| Monoisotopic Mass | 193.089149355 |
| 可旋转键计数 | 2 |
| 氢键供体计数 | 0 |
| 氢键受体计数 | 1 |
| 共价键单元计数 | 1 |
| 同位素原子计数 | 0 |
| 拓扑极性表面积 | 23.8 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 | 0 |
| 未定义原子手性中心计数 | 0 |
No upstream information yet
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