4-[Bis(3-methylphenyl)aminobenzaldehyde CAS NO.332411-18-4

1.Introduction of 332411-18-4

4-[Bis(3-methylphenyl)aminobenzaldehyde is the systematic name of this kind of product, and its CAS registry number is 332411

1.Introduction of 332411-18-4

4-[Bis(3-methylphenyl)aminobenzaldehyde is the systematic name of this kind of product, and its CAS registry number is 332411-18-4. Its IUPAC name is 4-(3-methyl-N-(3-methylphenyl)anilino)benzaldehyde. It has the appearance of yellow crystal powder with the purity of 99.0% in high qulity produced by our factory.

2.Properties of 332411-18-4

ACD/LogP: 6.143
# of Rule of 5 Violations: 1
ACD/LogD (pH 5.5): 6.14
ACD/LogD (pH 7.4): 6.14
ACD/BCF (pH 5.5): 27450.39
ACD/BCF (pH 7.4): 27450.39
ACD/KOC (pH 5.5): 52323.65
ACD/KOC (pH 7.4): 52323.65
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
Polar Surface Area: 20.31?²
Index of Refraction: 1.649
Molar Refractivity: 96.499 cm³
Molar Volume: 264.81 cm³
Polarizability: 38.255 10-24cm³
Surface Tension: 48.423999786377 dyne/cm
Density: 1.138 g/cm³
Flash Point: 182.395 °C
Enthalpy of Vaporization: 73.308 kJ/mol
Boiling Point: 470.51 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C

3.Structure Descriptors of 332411-18-4

(1)InChI: InChI=1S/C21H19NO/c1-16-5-3-7-20(13-16)22(21-8-4-6-17(2)14-21)19-11-9-18(15-23)10-12-19/h3-15H,1-2H3
(2)InChIKey: OLIQNHVNTIFEEX-UHFFFAOYSA-N
(3)Canonical SMILES : CC1=CC(=CC=C1)N(C2=CC=C(C=C2)C=O)C3=CC=CC(=C3)C