Ethanaminium,N-[4-[[4-(diethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl- | 18198-35-1
Ethanaminium,N-[4-[[4-(diethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-
18198-35-1
C27H33N2
385.5638
名称和标识符
InChIKey |
HXCILVUBKWANLN-UHFFFAOYSA-N |
Inchi |
InChI=1S/C27H33N2/c1-5-28(6-2)25-18-14-23(15-19-25)27(22-12-10-9-11-13-22)24-16-20-26(21-17-24)29(7-3)8-4/h9-21H,5-8H2,1-4H3/q+1 |
SMILES |
CCN(C1=CC=C(C(=C2C=CC(=[N+](CC)CC)C=C2)C2=CC=CC=C2)C=C1)CC |c:7,t:11| |
别名信息
- 英文别名 -
- Ethanaminium,N-[4-[[4-(diethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-
- [4-[[4-(diethylamino)phenyl]-phenylmethylidene]cyclohexa-2,5-dien-1-ylidene]-diethylazanium
- diethyl[4-[[4-(diethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]ammonium
- Diethyl(4-((4-(diethylamino)phenyl)phenylmethylene)-2,5-cyclohexadien-1-ylidene)ammonium
- N-(4-{[4-(diethylamino)phenyl](phenyl)methylidene}cyclohexa-2,5-dien-1-ylidene)-N-ethylethanaminium
- SCHEMBL115243
- SCHEMBL115243
- [4-[[4-(diethylamino)phenyl]-phenylmethylidene]-1-cyclohexa-2,5-dienylidene]-diethylammonium
- sulfuric acid
- [4-[[4-(diethylamino)phenyl]-phenylmethylidene]-1-cyclohexa-2,5-dienylidene]-diethylammonium
- sulfuric acid
- Green EN
- Green EN
- Ethanaminium, N-[4-[[4-(diethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-
- Ethanaminium, N-[4-[[4-(diethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-
- NCI60_004204
- NCI60_004204
- SR-01000879529-2
- SR-01000879529-2
- BDBM81263
- BDBM81263
- 18198-35-1
- 18198-35-1
- NS00017221
- NS00017221
- DB11279
- DB11279
- Q27160101
- Q27160101
- [4-[[4-(diethylamino)phenyl]-phenyl-methylene]cyclohexa-2,5-dien-1-ylidene]-diethyl-ammonium
- [4-[[4-(diethylamino)phenyl]-phenyl-methylene]cyclohexa-2,5-dien-1-ylidene]-diethyl-ammonium
- InChI=1/C27H33N2/c1-5-28(6-2)25-18-14-23(15-19-25)27(22-12-10-9-11-13-22)24-16-20-26(21-17-24)29(7-3)8-4/h9-21H,5-8H2,1-4H3/q+
- InChI=1/C27H33N2/c1-5-28(6-2)25-18-14-23(15-19-25)27(22-12-10-9-11-13-22)24-16-20-26(21-17-24)29(7-3)8-4/h9-21H,5-8H2,1-4H3/q+
- UNII-S85JD8CLBH
- UNII-S85JD8CLBH
- SAMPL5, CBC-G8
- SAMPL5, CBC-G8
- Deorlene Green JJO
- Deorlene Green JJO
- BDBM197321
- BDBM197321
- CHEMBL1589793
- CHEMBL1589793
- [4-[[4-(diethylamino)phenyl]-phenyl-methylidene]cyclohexa-2,5-dien-1-ylidene]-diethyl-azanium
- sulfuric acid
- [4-[[4-(diethylamino)phenyl]-phenyl-methylidene]cyclohexa-2,5-dien-1-ylidene]-diethyl-azanium
- sulfuric acid
- SR-01000879529-3
- SR-01000879529-3
- SMR001224398
- SMR001224398
- starbld0000854
- starbld0000854
- 4-{[4-(diethylamino)phenyl](phenyl)methylidene}-N,N-diethylcyclohexa-2,5-dien-1-iminium
- 4-{[4-(diethylamino)phenyl](phenyl)methylidene}-N,N-diethylcyclohexa-2,5-dien-1-iminium
- CHEBI:88176
- CHEBI:88176
- Basic Green V
- Basic Green V
- Brilliant Green cation
- Brilliant Green cation
- Basic Brilliant Green
- Basic Brilliant Green
- N-(4-((4-(diethylamino)phenyl)(phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)-N-ethylethanaminium
- N-(4-((4-(diethylamino)phenyl)(phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)-N-ethylethanaminium
- [4-[[4-(diethylamino)phenyl]-phenyl-methylene]cyclohexa-2,5-dien-1-ylidene]-diethyl-ammonium
- sulfuric acid
- [4-[[4-(diethylamino)phenyl]-phenyl-methylene]cyclohexa-2,5-dien-1-ylidene]-diethyl-ammonium
- sulfuric acid
- 12415 Green
- 12415 Green
- Diethyl[4-[[4-(diethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]ammonium
- Diethyl[4-[[4-(diethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]ammonium
- MLS001359824
- MLS001359824
- Brilliant Tungstate Green Toner GT-288
- Brilliant Tungstate Green Toner GT-288
- Solid Green
- Solid Green
- Basic Bright Green
- Basic Bright Green
- NCGC00166123-01
- NCGC00166123-01
- EINECS 242-088-5
- EINECS 242-088-5
- brilliant-green
- brilliant-green
- Brilliant green, free form
- Brilliant green, free form
- brilliant green(1+)
- brilliant green(1+)
- NSC5011
- NSC5011
- S85JD8CLBH
- S85JD8CLBH
- Brilliant green ion
- Brilliant green ion
- cid_407401
- cid_407401
- [4-[[4-(diethylamino)phenyl]-phenylmethylidene]cyclohexa-2,5-dien-1-ylidene]-diethylazanium
- sulfuric acid
- [4-[[4-(diethylamino)phenyl]-phenylmethylidene]cyclohexa-2,5-dien-1-ylidene]-diethylazanium
- sulfuric acid
- SR-01000879529
- SR-01000879529
- Avon Green A-4379
- Avon Green A-4379
- DTXSID40171223
- DTXSID40171223
- ETHANAMINIUM, N-(4-((4-(DIETHYLAMINO)PHENYL)PHENYLMETHYLENE)-2,5-CYCLOHEXADIEN-1-YLIDENE)-N-ETHYL-
- ETHANAMINIUM, N-(4-((4-(DIETHYLAMINO)PHENYL)PHENYLMETHYLENE)-2,5-CYCLOHEXADIEN-1-YLIDENE)-N-ETHYL-
物化性质
实验特性
沸点 |
°Cat760mmHg |
熔点 |
210 deg C, decomposes. |
闪点 |
°C |
密度 |
g/cm3 |
计算特性
精确分子量 |
385.264374 |
氢键供体数量 |
0 |
氢键受体数量 |
1 |
可旋转化学键数量 |
7 |
同位素质量 |
385.264374 |
重原子数量 |
29 |
复杂度 |
566 |
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) |
6.1 |
拓扑分子极性表面积 |
6.2 |
Ethanaminium,N-[4-[[4-(diethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-推荐生产厂家