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Name |
1,9-Nonanediamine,N1,N9-bis(3-aminopropyl)- |
EINECS | N/A |
CAS No. | 56-22-4 | Density | 0.904 g/cm3 |
PSA | 76.10000 | LogP | 3.77630 |
Solubility | N/A | Melting Point |
N/A |
Formula | C15H36N4 | Boiling Point | 365.1 °C at 760 mmHg |
Molecular Weight | 272.478 | Flash Point | 205.6 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1,9-Nonanediamine,N,N'-bis(3-aminopropyl)- (7CI,9CI);N,N'-Bis(3-aminopropyl)nonane-1,9-diamine;TE 393; |
Article Data | 2 |
The 1,9-Nonanediamine,N1,N9-bis(3-aminopropyl)-, with the CAS registry number 56-22-4, is also known as TE 393. This chemical's molecular formula is C15H36N4 and molecular weight is 272.477. What's more, both its IUPAC name and systematic name are the same which is called N,N'-Bis(3-aminopropyl)nonane-1,9-diamine.
Physical properties about 1,9-Nonanediamine,N1,N9-bis(3-aminopropyl)- are: (1)ACD/LogP: 1.39; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -4.7; (4)ACD/LogD (pH 7.4): -4.43; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4 ; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 18; (12)Polar Surface Area: 12.96 Å2; (13)Index of Refraction: 1.481; (14)Molar Refractivity: 85.8 cm3; (15)Molar Volume: 301.1 cm3; (16)Surface Tension: 37 dyne/cm; (17)Density: 0.904 g/cm3; (18)Flash Point: 205.6 °C; (19)Enthalpy of Vaporization: 61.14 kJ/mol; (20)Boiling Point: 365.1 °C at 760 mmHg; (21)Vapour Pressure: 1.6E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: NCCCNCCCCCCCCCNCCCN
(2) InChI: InChI=1/C15H36N4/c16-10-8-14-18-12-6-4-2-1-3-5-7-13-19-15-9-11-17/h18-19H,1-17H2
(3) InChIKey: JTXGXJZZAIHSKO-UHFFFAOYAR