-
Name
1,1'-[1,3-butadiene-1,4-diylbis[(5-methyl-2,6-benzoxazolediyl)methylene]]dipyridinium dichloride
- EINECS 301-224-4
- CAS No. 93982-35-5
- Density
- Solubility
- Melting Point
- Formula C32H28Cl2N4O2
- Boiling Point
- Molecular Weight 567.46456
- Flash Point
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 1,1'-(1,3-Butadiene-1,4-diylbis((5-methyl-2,6-benzoxazolediyl)methylene))dipyridinium dichloride;
- PSA 59.82000
- LogP -0.80800
Pyridinium,1,1'-[1,3-butadiene-1,4-diylbis[(5-methyl-2,6-benzoxazolediyl)methylene]]bis-,dichloride (9CI) Specification
The Pyridinium,1,1'-[1,3-butadiene-1,4-diylbis[(5-methyl-2,6-benzoxazolediyl)methylene]]bis-,dichloride (9CI), with the CAS registry number 93982-35-5, is also known as 1,1'-(1,3-Butadiene-1,4-diylbis((5-methyl-2,6-benzoxazolediyl)methylene))dipyridinium dichloride. Its EINECS registry number is 301-224-4. This chemical's molecular formula is C32H28Cl2N4O2 and molecular weight is 567.46456. Its IUPAC name is called 5-methyl-2-[4-[5-methyl-6-(pyridin-1-ium-1-ylmethyl)-1,3-benzoxazol-2-yl]buta-1,3-dienyl]-6-(pyridin-1-ium-1-ylmethyl)-1,3-benzoxazole dichloride.
Physical properties of Pyridinium,1,1'-[1,3-butadiene-1,4-diylbis[(5-methyl-2,6-benzoxazolediyl)methylene]]bis-,dichloride (9CI): (1)H-Bond Donor: 0; (2)H-Bond Acceptor: 6; (3)Rotatable Bond Count: 5; (4)Exact Mass: 566.127631; (5)MonoIsotopic Mass: 566.127631; (6)Topological Polar Surface Area: 59.8; (7)Heavy Atom Count: 40; (8)Formal Charge: 0; (9)Complexity: 883; (10)Isotope Atom Count: 0; (11)Defined Atom StereoCenter Count: 0; (12)Undefined Atom StereoCenter Count: 2; (13)Defined Bond StereoCenter Count: 2; (14)Undefined Bond StereoCenter Count: 0; (15)Covalently-Bonded Unit Count: 3.
You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].[Cl-].Cc2cc3nc(oc3cc2C[n+]1ccccc1)C=CC=Cc4nc5cc(C)c(cc5o4)C[n+]6ccccc6
(2)InChI: InChI=1/C32H28N4O2.2ClH/c1-23-17-27-29(19-25(23)21-35-13-7-3-8-14-35)37-31(33-27)11-5-6-12-32-34-28-18-24(2)26(20-30(28)38-32)22-36-15-9-4-10-16-36;;/h3-20H,21-22H2,1-2H3;2*1H/q+2;;/p-2
(3)InChIKey: PPMSUIPIXMKOBG-NUQVWONBAE
Related Products
- Pyridinium, 1-(2-((4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy)ethyl)-, bromide
- Pyridinium, 1-(2-amino-2-oxoethyl)-4-methyl-, chloride(1:1)
- Pyridinium, 2-amino-1-methyl-, iodide
- Pyridinium, 3,3'-(2-methoxyterephthaloylbis(imino-p-phenylenecarbonylimino))bis(1-ethyl-, di-p-toluenesulfonate
- Pyridinium, 3,3'-(2-methoxyterephthaloylbis(imino-p-phenylenecarbonylimino))bis(1-methyl-, di-p-toluenesulfonate
- Pyridinium, 3,3'-(2-methoxyterephthaloylbis(imino-p-phenylenecarbonylimino))bis(1-propyl-, di-p-toluenesulfonate
- Pyridinium, 3,3'-(2-methylterephthaloylbis(imino-p-phenylenecarbonylimino))bis(1-ethyl-, di-p-toluenesulfonate
- Pyridinium, 3,3'-(2-methylterephthaloylbis(imino-p-phenylenecarbonylimino))bis(1-methyl-, di-p-toluenesulfonate
- Pyridinium, 3,3'-(2-methylterephthaloylbis(imino-p-phenylenecarbonylimino))bis(1-propyl-, di-p-toluenesulfonate
- Pyridinium, 3,3'-(bicyclo(2.2.2)octane-1,4-diylbis(carbonylimino-4,1-phenylenecarbonylimino))bis(1-propyl-, salt with 4-methylbenzenesulfonic acid (1:2)
- 93982-47-9
- 93982-48-0
- 93982-54-8
- 93982-70-8
- 93982-77-5
- 93982-85-5
- 93982-95-7
- 93982-96-8
- 93983-12-1
- 93983-13-2
Hot Products
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View