Benz[j]aceanthrylene,1,2-dihydro-4-methyl- (9CI) | 17012-89-4
Benz[j]aceanthrylene,1,2-dihydro-4-methyl- (9CI)
17012-89-4
C21H16
268.35174
名称和标识符
| InChIKey |
DYGZCALVTOKEJQ-UHFFFAOYSA-N |
| Inchi |
InChI=1S/C21H16/c1-13-10-15-7-9-19-18-8-6-14-4-2-3-5-17(14)20(18)12-16(11-13)21(15)19/h2-6,8,10-12H,7,9H2,1H3 |
| SMILES |
CC1C=C2C3=C(C4C=CC5=CC=CC=C5C=4C=C3C=1)CC2 |
别名信息
- 英文别名 -
- Benz[j]aceanthrylene,1,2-dihydro-4-methyl- (9CI)
- 4-methyl-1,2-dihydrobenzo[j]aceanthrylene
- Cholanthrene, 4-methyl-
- 1,2-Dihydro-4-methylbenz(j)aceanthrylene
- 22-Methylcholanthrene
- 4-methyl-1,2-dihydrocyclopenta[ij]tetraphene
- 4-Methylcholanthrene
- Benz(j)aceanthrylene, 1,2-dihydro-4-methyl- (9CI)
- BRN 3316624
- 1,2-Dihydro-4-methylbenz[j]aceanthrylene
- Benz(j)aceanthrylene, 1,2-dihydro-4-methyl-
- DTXSID90168800
- 17012-89-4
- C21H16
物化性质
实验特性
| PSA |
0 |
| 折射率 |
1.7640 (estimate) |
| 沸点 |
346.52°C (rough estimate) |
| 熔点 |
154.75°C |
| 闪点 |
251.4°C |
| 密度 |
1.1003 (estimate) |
计算特性
| 精确分子量 |
268.12528 |
| 氢键供体数量 |
0 |
| 氢键受体数量 |
0 |
| 可旋转化学键数量 |
0 |
| 同位素质量 |
268.125201 |
| 重原子数量 |
21 |
| 复杂度 |
399 |
| 同位素原子数量 |
0 |
| 确定原子立构中心数量 |
0 |
| 不确定原子立构中心数量 |
0 |
| 确定化学键立构中心数量 |
0 |
| 不确定化学键立构中心数量 |
0 |
| 共价键单元数量 |
1 |
| 疏水参数计算参考值（XlogP） |
6.3 |
| 拓扑分子极性表面积 |
0 |
Benz[j]aceanthrylene,1,2-dihydro-4-methyl- (9CI)推荐生产厂家
![3,4-二氢苯并[GHI]二萘嵌苯](https://scimg.chem960.com/cas/0/16310-65-9.png "16310-65-9 3,4-二氢苯并[GHI]二萘嵌苯")
商务合作对接
关注官方微信公众号
微信扫码联系客服
![Benz[j]aceanthrylene,1,2-dihydro-4-methyl- (9CI)结构式图片|17012-89-4结构式图片](https://scimg.chem960.com/cas/150/17012-89-4.png?t=638489121872829456)
