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77061-58-6

Basic Information
CAS No.: 77061-58-6
Name: 1H-Imidazolium, 2-(2-(4-(dimethylamino)phenyl)diazenyl)-1,3-dimethyl-, chloride (1:1)
Molecular Structure:
Molecular Structure of 77061-58-6 (1H-Imidazolium, 2-(2-(4-(dimethylamino)phenyl)diazenyl)-1,3-dimethyl-, chloride (1:1))
Formula: C13H18ClN5
Molecular Weight: 279.76852
Synonyms: 1H-Imidazolium,2-[[4-(dimethylamino)phenyl]azo]-1,3-dimethyl-, chloride (9CI);
EINECS: 278-601-4
Density: N/A
Melting Point: N/A
Boiling Point: N/A
Flash Point: N/A
Solubility: N/A
Appearance: N/A
Hazard Symbols: N/A
Risk Codes: N/A
Safety:
Transport Information: N/A
PSA: 36.77000
LogP: -0.66500
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Specification

The Basic Red 51 is an organic compound with the formula C13H18ClN5. The IUPAC name of this chemical is 4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]-N,N-dimethylaniline chloride. With the CAS registry number 77061-58-6, it is also named as 2-((4-(Dimethylamino)phenyl)azo)-1,3-dimethyl-1H-imidazolium chloride.

The other characteristics of this product can be summarized as: (1)#H bond acceptors: 5; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 3; (4)Rotatable Bond Count: 3; (5)Exact Mass: 279.125073; (6)MonoIsotopic Mass: 279.125073; (7)Topological Polar Surface Area: 36.8; (8)Heavy Atom Count: 19; (9)Complexity: 273; (10)Covalently-Bonded Unit Count: 2.

People can use the following data to convert to the molecule structure. 
1. SMILES: [Cl-].N(=N/c1[n+](ccn1C)C)\c2ccc(N(C)C)cc2;
2. InChI: InChI=1/C13H18N5.ClH/c1-16(2)12-7-5-11(6-8-12)14-15-13-17(3)9-10-18(13)4;/h5-10H,1-4H3;1H/q+1;/p-1;
3. InChIKey: NZDXSXLYLMHYJA-REWHXWOFAW.