-
Name
2-((E)-2-(2-METHOXY-3-[(E)-2-(1,3,3-TRIMETHYL-1,3-DIHYDRO-2H-INDOL-2-YLIDENE)ETHYLIDENE]-1-CYCLOHEXEN-1-YL)ETHENYL)-1,3,3-TRIMETHYL-3H-INDOLIUM PERCHLORATE
- EINECS
- CAS No. 70446-24-1
- Density
- Solubility
- Melting Point
- Formula C33H39N2O.ClO4
- Boiling Point
- Molecular Weight 579.13
- Flash Point
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 3H-Indolium, 2-[2-[3-[(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]-2-methoxy-1-cyclohexen-1-yl]ethenyl]-1,3,3-trimethyl-, perchlorate (9CI);
- PSA 89.75000
- LogP 7.80920
2-((E)-2-(2-Methoxy-3-[(E)-2-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl)ethenyl)-1,3,3-trimethyl-3H-indolium perchlorate Specification
The 2-((E)-2-(2-Methoxy-3-[(E)-2-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl)ethenyl)-1,3,3-trimethyl-3H-indolium perchlorate, with the CAS number 70446-24-1, is also called 3H-Indolium, 2-[2-[3-[(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]-2-methoxy-1-cyclohexen-1-yl]ethenyl]-1,3,3-trimethyl-, perchlorate (9CI). Its molecular formula is C33H39ClN2O5.
You can still convert the following datas into molecular structure:
(1)SMILES: CC1(c2ccccc2[N+](=C1C=CC3=C(C(=CC=C4C(c5ccccc5N4C)(C)C)CCC3)OC)C)C.[O-]Cl(=O)(=O)=O
(2)InChI: InChI=1/C33H39N2O.ClHO4/c1-32(2)25-15-8-10-17-27(25)34(5)29(32)21-19-23-13-12-14-24(31(23)36-7)20-22-30-33(3,4)26-16-9-11-18-28(26)35(30)6;2-1(3,4)5/h8-11,15-22H,12-14H2,1-7H3;(H,2,3,4,5)/q+1;/p-1
(3)InChIKey: ZWFWFGLXKWXXDA-REWHXWOFAB
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