CAS No.69938-76-7,4,4'-Hexamethylenebis(1,1-dimethylsemicarbazide) Suppliers

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Basic Information

Molecular Structure:
CAS No.:	69938-76-7
Name:	4,4'-Hexamethylenebis(1,1-dimethylsemicarbazide)

Formula:	C₁₂H₂₈N₆O₂
Molecular Weight:	288.393
Synonyms:	1,6-Hexamethylenebis(N,N-dimethylsemicarbazide);1,6-Hexamethylenebis(dimethylsemicarbazide);AF 24;Antifade 3000;HN 130;HN200;
Density:	1.065 g/cm³
Melting Point:	20-23°C(lit.)
Boiling Point:	236-237°C(lit.)
Flash Point:	>230°F
Risk Codes:	R36/37/38
PSA:	88.74000
LogP:	1.66200

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Specification

The Hydrazinecarboxamide,N,N'-1,6-hexanediylbis[2,2-dimethyl-, with its CAS registry number 69938-76-7, has the IUPAC name of 1-(dimethylamino)-3-[6-(dimethylaminocarbamoylamino)hexyl]urea. And it has the systematic name of N,N'-hexane-1,6-diylbis(2,2-dimethylhydrazinecarboxamide).

The physical properties of this chemical are as below: (1)ACD/LogP: -0.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.89; (4)ACD/LogD (pH 7.4): -0.88; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 7.77; (8)ACD/KOC (pH 7.4): 7.92; (9)#H bond acceptors: 8; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 53.58; (13)Index of Refraction: 1.499; (14)Molar Refractivity: 79.52 cm³; (15)Molar Volume: 270.6 cm³; (16)Polarizability: 31.52×10^-24 cm³; (17)Surface Tension: 40.5 dyne/cm; (18)Density: 1.065 g/cm³; (19)Exact Mass: 288.227374; (20)MonoIsotopic Mass: 288.227374; (21)Topological Polar Surface Area: 88.7; (22)Heavy Atom Count: 20; (23)Complexity: 255.

Production method of this chemical: N,N-dimethyl-hydrazine could react with 1,6-diisocyanato-hexane to produce Hydrazinecarboxamide,N,N'-1,6-hexanediylbis[2,2-dimethyl-. This reaction could happen in the presence of the solvent of benzene with the yield of 98%.

Additionally, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: CN(C)NC(=O)NCCCCCCNC(=O)NN(C)C
(2)InChI: InChI=1S/C12H28N6O2/c1-17(2)15-11(19)13-9-7-5-6-8-10-14-12(20)16-18(3)4/h5-10H2,1-4H3,(H2,13,15,19)(H2,14,16,20)
(3)InChIKey: VETHREXFBVHLJJ-UHFFFAOYSA-N