Amines,N,N'-bis(3-aminopropyl)-C36-alkylenedi- supplier

Name
Amines, N,N-bis(3-aminopropyl)-C36-alkylenedi-
EINECS
CAS No. 71076-95-4
Density 0.871 g/cm³
Solubility
Melting Point
Formula C₄₂H₉₀N₄
Boiling Point 715.5 °C at 760 mmHg
Molecular Weight 651.1908
Flash Point 464 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms N,N'-bis(3-aminopropyl)hexatriacontane-1,36-diamine;Amines, N,N'-bis(3-aminopropyl)-C36-alkylenedi-;
PSA 76.10000
LogP 14.30900

Amines,N,N'-bis(3-aminopropyl)-C36-alkylenedi- Specification

The Amines,N,N'-bis(3-aminopropyl)-C36-alkylenedi-, with cas registry number of 71076-95-4, has the systematic name and IUPAC name of N,N'-bis(3-aminopropyl)hexatriacontane-1,36-diamine. And the molecular formula of the chemical is C₄₂H₉₀N₄.

The characteristics of Amines,N,N'-bis(3-aminopropyl)-C36-alkylenedi- are as followings: (1)ACD/LogP: 15.74; (2)# of Rule of 5 Violations: 3; (3)ACD/LogD (pH 5.5): 9.64; (4)ACD/LogD (pH 7.4): 9.92; (5)ACD/BCF (pH 5.5): 431213.81; (6)ACD/BCF (pH 7.4): 809520.63; (7)ACD/KOC (pH 5.5): 6956.87; (8)ACD/KOC (pH 7.4): 13060.19; (9)#H bond acceptors: 4; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 45; (12)Polar Surface Area: 12.96 Å²; (13)Index of Refraction: 1.476; (14)Molar Refractivity: 210.88 cm³; (15)Molar Volume: 746.8 cm³; (16)Polarizability: 83.6×10^-24cm³; (17)Surface Tension: 35 dyne/cm; (18)Density: 0.871 g/cm³; (19)Flash Point: 464 °C; (20)Enthalpy of Vaporization: 104.57 kJ/mol; (21)Boiling Point: 715.5 °C at 760 mmHg; (22)Vapour Pressure: 2.55E-20 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: NCCCNCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCNCCCN
(2)InChI: InChI=1/C42H90N4/c43-37-35-41-45-39-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-40-46-42-36-38-44/h45-46H,1-44H2
(3)InChIKey: OFFBTFONFHSIGA-UHFFFAOYAJ

Product Name

Amines, N,N-bis(3-aminopropyl)-C36-alkylenedi-

Amines,N,N'-bis(3-aminopropyl)-C36-alkylenedi- Specification

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