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1,2-Ethanediamine, N-(2-aminoethyl)-N-dodecyl-

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Name

1,2-Ethanediamine, N-(2-aminoethyl)-N-dodecyl-

EINECS 224-056-2
CAS No. 4182-44-9 Density 0.883 g/cm3
PSA 55.28000 LogP 4.52730
Solubility N/A Melting Point N/A
Formula C16H37N3 Boiling Point 355.5 °C at 760 mmHg
Molecular Weight 271.49 Flash Point 166.3 °C
Transport Information N/A Appearance clear slightly yellow liquid
Safety 45-36/37/39-26 Risk Codes 34
Molecular Structure Molecular Structure of 4182-44-9 (4-DODECYLDIETHYLENETRIAMINE) Hazard Symbols CorrosiveC
Synonyms

N-(2-aminoethyl)-N-dodecyl-ethane-1,2-diamine;N-(2-Aminoethyl)-N-dodecylethylenediamine;

 

1,2-Ethanediamine, N-(2-aminoethyl)-N-dodecyl- Specification

This chemical is called 1,2-Ethanediamine, N-(2-aminoethyl)-N-dodecyl-, and its systematic name is N-(2-aminoethyl)-N-dodecylethane-1,2-diamine. With the molecular formula of C16H37N3, its molecular weight is 271.4851. The CAS registry number of this chemical is 4182-44-9.

Other characteristics of the 1,2-Ethanediamine, N-(2-aminoethyl)-N-dodecyl- can be summarised as followings: (1)ACD/LogP: 4.08; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.03; (4)ACD/LogD (pH 7.4): 0.34; (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: 3; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 17; (12)Polar Surface Area: 9.72 Å2; (13)Index of Refraction: 1.477; (14)Molar Refractivity: 86.96 cm3; (15)Molar Volume: 307.2 cm3; (16)Polarizability: 34.47×10-24cm3; (17)Surface Tension: 35.9 dyne/cm; (18)Density: 0.883 g/cm3; (19)Flash Point: 166.3 °C; (20)Enthalpy of Vaporization: 60.06 kJ/mol; (21)Boiling Point: 355.5 °C at 760 mmHg; (22)Vapour Pressure: 3.12E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical causes burns. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure: 
1.SMILES: NCCN(CCCCCCCCCCCC)CCN
2.InChI: InChI=1/C16H37N3/c1-2-3-4-5-6-7-8-9-10-11-14-19(15-12-17)16-13-18/h2-18H2,1H3
3.InChIKey: BRNPMBFYMPUNSK-UHFFFAOYAF

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