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| Name |
3H-Indolium, 2-(2-(4-((2-chloroethyl)ethylamino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-, chloride (1:1) |
EINECS | 229-227-5 |
| CAS No. | 6441-82-3 | Density | 0.97[at 20℃] |
| PSA | 6.25000 | LogP | 2.74230 |
| Solubility | 12.59mg/L at 25℃ | Melting Point |
N/A |
| Formula | C24H30Cl2N2 | Boiling Point | 628.51℃[at 101 325 Pa] |
| Molecular Weight | 417.41 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
2-[4-[(2-Chloroethyl)ethylamino]-2-methylstyryl]-1,3,3-trimethyl-3H-indoliumchloride (6CI,7CI);3H-Indolium,2-[2-[4-[(2-chloroethyl)ethylamino]-2-methylphenyl]ethenyl]-1,3,3-trimethyl-,chloride (9CI);3H-Indolium,2-[4-[(2-chloroethyl)ethylamino]-2-methylstyryl]-1,3,3-trimethyl-, chloride(8CI);Aizen Cathilon Red 6B;Aizen Cathilon Red 6BH;Astrazon Red 6B;Basicviolet 7;C.I. 48020;C.I. Basic Violet 7;Cationic Red 6B;Genacryl Red 6B;Nabor Brilliant Red 6B;Red Astrazone 66;Stenacrile Brilliant Red 6B;Sumiacryl Red 6B; |
3H-Indolium, 2-(2-(4-((2-chloroethyl)ethylamino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-, chloride (1:1) Specification
The 3H-Indolium,2-[2-[4-[(2-chloroethyl)ethylamino]-2-methylphenyl]ethenyl]-1,3,3-trimethyl-,chloride (1:1), with the CAS registry number 6441-82-3, is also known as Aizen Cathilon Red 6B. It belongs to the product categories of Organics; Indoles; Simple Indoles. Its EINECS registry number is 229-227-5. This chemical's molecular formula is C24H30Cl2N2 and molecular weight is 417.41. Its IUPAC name is called N-(2-chloroethyl)-N-ethyl-3-methyl-4-[2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]aniline chloride.
Physical properties of 3H-Indolium,2-[2-[4-[(2-chloroethyl)ethylamino]-2-methylphenyl]ethenyl]-1,3,3-trimethyl-,chloride (1:1): ((1)H-Bond Donor: 0; (2)H-Bond Acceptor: 2; (3)Rotatable Bond Count: 6; (4)Exact Mass: 416.178604; (5)MonoIsotopic Mass: 416.178604; (6)Topological Polar Surface Area: 6.2; (7)Heavy Atom Count: 28; (8)Formal Charge: 0; (9)Complexity: 565; (10)Undefined Bond StereoCenter Count: 1; (11)Covalently-Bonded Unit Count: 2.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCN(CCCl)C1=CC(=C(C=C1)C=CC2=[N+](C3=CC=CC=C3C2(C)C)C)C.[Cl-]
(2)InChI: InChI=1S/C24H30ClN2.ClH/c1-6-27(16-15-25)20-13-11-19(18(2)17-20)12-14-23-24(3,4)21-9-7-8-10-22(21)26(23)5;/h7-14,17H,6,15-16H2,1-5H3;1H/q+1;/p-1
(3)InChIKey: JQZWHMOVSQRYRN-UHFFFAOYSA-M
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