Tris(4-iodophenyl)amine CAS NO.4181-20-8

1.Introduction of 4181-20-8

Tris(4-iodophenyl)amine has the CAS registry number is 4181-20-8. It has synonyms of tri(4-iodophenyl)amine, tris

1.Introduction of 4181-20-8

Tris(4-iodophenyl)amine has the CAS registry number is 4181-20-8. It has synonyms of tri(4-iodophenyl)amine, tris(4-iodophenyl)amine, trisiodophenylamine, 3-amino-4-ethylpyrazole oxalate, 4,4',4''-nitrilotris(1-iodobenzene), tris(4-iodophenyl)amine. Our product in the market has the purity of 98.0% and it appearance is yellow crystal powder. It is used as one kind of amines and electronic chemicals.

2.Properties of 4181-20-8

ACD/LogP: 9.146
# of Rule of 5 Violations: 2
ACD/LogD (pH 5.5): 9.15
ACD/LogD (pH 7.4): 9.15
ACD/BCF (pH 5.5): 1000000.00
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 5.5): 2251171.00
ACD/KOC (pH 7.4): 2251171.00
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
Polar Surface Area: 3.24?²
Index of Refraction: 1.767
Molar Refractivity: 118.817 cm³
Molar Volume: 286.812 cm³
olarizability: 47.103 10-24cm³
Surface Tension: 62.068000793457 dyne/cm
Density: 2.172 g/cm³
Flash Point: 292.185 °C
Enthalpy of Vaporization: 84.186 kJ/mol
Boiling Point: 559.515 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C

3.Structure Descriptors of 4181-20-8

(1)InChI: InChI=1S/C18H12I3N/c19-13-1-7-16(8-2-13)22(17-9-3-14(20)4-10-17)18-11-5-
15(21)6-12-18/h1-12H
(2)InChIKey: AQGZDWJFOYXGAA-UHFFFAOYSA-N
(3)Canonical SMILES : C1=CC(=CC=C1N(C2=CC=C(C=C2)I)C3=CC=C(C=C3)I)I