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Tris(2-pyridylmethyl)amine (16858-01-8)

Identification
Name:Tris(2-pyridylmethyl)amine
Synonyms:N,N,N-Tris(2-pyridinylmethyl)amine;
CAS:16858-01-8
Molecular Formula: C18H18N4
Molecular Weight: 290.36
InChI: InChI=1/C18H18N4/c1-4-10-19-16(7-1)13-22(14-17-8-2-5-11-20-17)15-18-9-3-6-12-21-18/h1-12H,13-15H2
Molecular Structure: (C18H18N4) N,N,N-Tris(2-pyridinylmethyl)amine;
Properties
Flash Point: 409.8 ºC at 760 mmHg
Boiling Point: 409.8 ºC at 760 mmHg
Density:1.175g/cm3
Refractive index:1.625
Specification:

Tris(2-pyridylmethyl)amine ,withe the CAS register number 16858-01-8, has the systematic name of
1-(pyridin-2-yl)-N,N-bis(pyridin-2-ylmethyl)methanamine . And it is also known to us as 2-pyridinemethanamine, N,N-bis(2-pyridinylmethyl)- ,2-Pyridinyl-N,N-bis(2-pyridinylmethyl)methanamine , or N,N,N-Tris(2-pyridinylmethyl)amine .

Characteristics of this kind of chemical are as followings: (1)ACD/LogP:  1.19 ; (2)ACD/LogD (pH 5.5):  1.04  ; (3)ACD/LogD (pH 7.4):  1.19  ; (4)ACD/BCF (pH 5.5):  3.31  ; (5)ACD/BCF (pH 7.4):  4.72  ; (6)ACD/KOC (pH 5.5):  74.14  ; (7)ACD/KOC (pH 7.4):  105.46  ; (8)#H bond acceptors:  4  ; (9)#Freely Rotating Bonds:  6  ; (10)Polar Surface Area:  41.91  ; (11)Index of Refraction:  1.625  ; (12)Molar Refractivity:  87.4 cm ; (13)Molar Volume:  247 cm3  ; (14)Polarizability:  34.65 ×10-24cm3  ; (15)Surface Tension:  56 dyne/cm  ; (16)Density:  1.175 g/cm ; (17)Flash Point:  201.6 °C  ; (18)Enthalpy of Vaporization:  66.2 kJ/mol  ; (19)Boiling Point:  409.8 °C at 760 mmHg  ; (20)Vapour Pressure:  6.34E-07 mmHg at 25°C . This kind of chemical is irritant to the skin and may cause damage to health. If swallowed, seek medical help immediately.

In addition, you could also convert the following data information into the molecular structure:
SMILES: n1ccccc1CN(Cc2ncccc2)Cc3ncccc3
InChI: InChI=1/C18H18N4/c1-4-10-19-16(7-1)13-22(14-17-8-2-5-11-20-17)15-18-9-3-6-12-21-18/h1-12H,13-15H2 InChIKey: VGUWFGWZSVLROP-UHFFFAOYAQ

Tris(2-pyridylmethyl)amine is provided by many suppliers around the world, such as Wuxi InterpiPharm, Inc. and TCI (Shanghai) Development Co., Ltd. 
 

Flash Point: 409.8 ºC at 760 mmHg
Safety Data