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4657-00-5

Basic Information
CAS No.: 4657-00-5
Name: ASTRAZON ORANGE R
Molecular Structure:
Molecular Structure of 4657-00-5 (ASTRAZON ORANGE R)
Formula: C28H27ClN2
Molecular Weight: 426.989
Synonyms: 1,3,3-Trimethyl-2-[2-(1-methyl-2-phenyl-3-indolyl)vinyl]-3H-indoliumchloride (6CI,7CI);3H-Indolium,1,3,3-trimethyl-2-[2-(1-methyl-2-phenyl-1H-indol-3-yl)ethenyl]-, chloride(9CI);3H-Indolium, 1,3,3-trimethyl-2-[2-(1-methyl-2-phenylindol-3-yl)vinyl]-,chloride (8CI);Aizen Cathilon Orange RH;Aizen Cathilon Orange RL;AstrazonOrange R;Basic Orange 22;C.I. 48040;C.I. Basic Orange 22;Genacryl Orange R;Nabor Orange R;Orange Astrazon R;Sumiacryl Orange R;
EINECS: 225-097-9
Density: 1.25[at 20℃]
Solubility: 7.7g/L at 20℃
PSA: 7.94000
LogP: 3.52750
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Specification

This chemical is called 3H-Indolium, 1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)ethenyl)-, chloride (1:1), and it can also be named as C.I. Basic Orange 22. With the CAS registry number of 4657-00-5, its product categories are Indoles; Simple Indoles. Additionally, this chemical is dark orange powder, and it's soluble in water. This chemical is mainly used for dyeing of acrylic and their blends.

Other characteristics of the 3H-Indolium, 1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)ethenyl)-, chloride (1:1) can be summarised as followings: (1)#H bond acceptors: 2; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 6.25 Å2.

You can still convert the following datas into molecular structure:
1.InChI: InChI=1/C28H27N2.ClH/c1-28(2)23-15-9-11-17-25(23)29(3)26(28)19-18-22-21-14-8-10-16-24(21)30(4)27(22)20-12-6-5-7-13-20;/h5-19H,1-4H3;1H/q+1;/p-1
2.Smiles: c1(c(n(C)c2c1cccc2)c1ccccc1)\C=C\C1=[N+](c2ccccc2C1(C)C)C.[ClH-]