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N,N-(Iminodiethylene)bis(dodecanamide)

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Name

N,N-(Iminodiethylene)bis(dodecanamide)

EINECS 256-123-7
CAS No. 43161-97-3 Density 0.914 g/cm3
PSA 77.21000 LogP 8.72170
Solubility N/A Melting Point N/A
Formula C28H57N3O2 Boiling Point 650.6 °C at 760 mmHg
Molecular Weight 467.779 Flash Point 141.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 43161-97-3 (N,N'-(iminodiethylene)bis(dodecanamide)) Hazard Symbols N/A
Synonyms

N-[2-[2-(dodecanoylamino)ethylamino]ethyl]dodecanamide;Dodecanamide, N,N'-(iminodi-2,1-ethanediyl)bis-;N,N'-(Iminodiethane-2,1-diyl)didodecanamide;

Article Data 3

N,N-(Iminodiethylene)bis(dodecanamide) Specification

This chemical is called N,N-(Iminodiethylene)bis(dodecanamide), and it can also be named as N-[2-[2-(dodecanoylamino)ethylamino]ethyl]dodecanamide. With the molecular formula of C28H57N3O2, its molecular weight is 467.77108. The CAS registry number of this chemical is 43161-97-3, and its EINECS number is 256-123-7. Additionally, its systematic name is N,N'-(iminodiethane-2,1-diyl)didodecanamide. 

Other characteristics of the N,N-(Iminodiethylene)bis(dodecanamide) can be summarised as followings: (1)ACD/LogP: 8.56; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.28; (4)ACD/LogD (pH 7.4): 7.98; (5)ACD/BCF (pH 5.5): 9837.68; (6)ACD/BCF (pH 7.4): 493123.28; (7)ACD/KOC (pH 5.5): 5638.96; (8)ACD/KOC (pH 7.4): 282658.47; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 26; (12)Polar Surface Area: 43.86 Å2; (13)Index of Refraction: 1.469; (14)Molar Refractivity: 142.61 cm3; (15)Molar Volume: 511.4 cm3; (16)Polarizability: 56.53×10-24 cm3; (17)Surface Tension: 34.5 dyne/cm; (18)Density: 0.914 g/cm3; (19)Flash Point: 141.3 °C; (20)Enthalpy of Vaporization: 95.88 kJ/mol; (21)Boiling Point: 650.6 °C at 760 mmHg; (22)Vapour Pressure: 8.3E-17 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(NCCNCCNC(=O)CCCCCCCCCCC)CCCCCCCCCCC
2.InChI: InChI=1/C28H57N3O2/c1-3-5-7-9-11-13-15-17-19-21-27(32)30-25-23-29-24-26-31-28(33)22-20-18-16-14-12-10-8-6-4-2/h29H,3-26H2,1-2H3,(H,30,32)(H,31,33)
3.InChIKey: BGEMFQCZIBYDGZ-UHFFFAOYAF

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