N,N'-(Methylenedi-p-phenylene)bis(aziridine-1-carboxamide) supplier

Name
N,N'-(methylenedi-p-phenylene)bis(aziridine-1-carboxamide)
EINECS 231-034-6
CAS No. 7417-99-4
Density 1.427 g/cm³
Solubility 47.59mg/L at 25℃
Melting Point 168-169 °C(Solv: ethanol (64-17-5))
Formula C₁₉H₂₀N₄O₂
Boiling Point 550.74℃[at 101 325 Pa]
Molecular Weight 336.393
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-Aziridinecarboxanilide,4',4'''-methylenebis- (7CI,8CI);4,4'-Bis(3,3-ethyleneureido)diphenylmethane;4,4'-Bis(N',N'-ethyleneureido)diphenylmethane;4,4'-Bis(ethyleneiminocarbonylamino)diphenylmethane;4,4'-Diphenylmethanebis(ethyleneurea);Chemitite DZ 22;Chemitite DZ 22E;Chemitite DZ 22N;DZ 22;Diphenylmethane 4,4'-diethyleneurea;Diphenylmethane-4,4'-bis(N,N-diethyleneurea);Diphenylmethane-4,4'-bis(N,N-ethyleneurea);Diphenylmethane-4,4'-bis(ethyleneurea);FS 50;FS 50 (crosslinking agent);Millionate MEW;Millionate MEW-A;NSC 26234;p,p'-Bis(ethyleneureido)diphenylmethane;
PSA 64.22000
LogP 2.99420

Synthetic route

: 151-56-4
ethyleneimine

: 101-68-8
di(4-isocyanatophenyl)methane

: 7417-99-4
bis-[4-(aziridine-1-carbonylamino)-phenyl]-methane

Conditions

Conditions	Yield
With toluene
With acetone

: 7417-99-4
bis-[4-(aziridine-1-carbonylamino)-phenyl]-methane

: 13908-71-9
1,1'-(methylenedi-p-phenylene)bis[3-(2-chloroethyl)-urea]

Conditions

Conditions	Yield
With hydrogenchloride

N,N'-(Methylenedi-p-phenylene)bis(aziridine-1-carboxamide) Specification

The N,N'-(Methylenedi-p-phenylene)bis(aziridine-1-carboxamide), with the CAS registry number 7417-99-4, is also known as 4,4'-Bis(ethyleneiminocarbonylamino)diphenylmethane. Its EINECS number is 231-034-6. This chemical's molecular formula is C₁₉H₂₀N₄O₂ and molecular weight is 336.39. What's more, its systematic name is N,N'-(Methylenedi-4,1-phenylene)bis(1-aziridinecarboxamide).

Physical properties of N,N'-(Methylenedi-p-phenylene)bis(aziridine-1-carboxamide) are: (1)ACD/LogP: -0.326; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.33; (4)ACD/LogD (pH 7.4): -0.33; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 15.84; (8)ACD/KOC (pH 7.4): 15.84; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 64.22 Å²; (13)Index of Refraction: 1.751; (14)Molar Refractivity: 96.147 cm³; (15)Molar Volume: 235.755 cm³; (16)Polarizability: 38.116×10^-24cm³; (17)Surface Tension: 84.6 dyne/cm; (18)Density: 1.427 g/cm³.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1ccc(cc1)Cc3ccc(NC(=O)N2CC2)cc3)N4CC4
(2)Std. InChI: InChI=1S/C19H20N4O2/c24-18(22-9-10-22)20-16-5-1-14(2-6-16)13-15-3-7-17(8-4-15)21-19(25)23-11-12-23/h1-8H,9-13H2,(H,20,24)(H,21,25)
(3)Std. InChIKey: XECQDYXJWMHGBI-UHFFFAOYSA-N

Product Name

N,N'-(methylenedi-p-phenylene)bis(aziridine-1-carboxamide)

Synthetic route

N,N'-(Methylenedi-p-phenylene)bis(aziridine-1-carboxamide) Specification

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