Product Name

  • Name

    4-(DIBENZYLAMINO)BENZALDEHYDE-N,N-DIPHENYLHYDRAZONE

  • EINECS
  • CAS No. 85171-94-4
  • Density 1.046 g/cm3
  • Solubility
  • Melting Point 148-152 °C
  • Formula C33H29N3
  • Boiling Point 646.713 °C at 760 mmHg
  • Molecular Weight 467.6
  • Flash Point 344.919 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 85171-94-4 (4-(DIBENZYLAMINO)BENZALDEHYDE-N,N-DIPHENYLHYDRAZONE)
  • Hazard Symbols
  • Synonyms Benzaldehyde,4-[bis(phenylmethyl)amino]-, diphenylhydrazone (9CI);p-(Dibenzylamino)benzaldehyde diphenylhydrazone;4-(Dibenzylamino)benzaldehyde-N,N-diphenylhydrazone;N,N-Dibenzyl-4-[(E)-(diphenylhydrazono)methyl]aniline;
  • PSA 18.84000
  • LogP 8.06560

Benzaldehyde,4-[bis(phenylmethyl)amino]-, 2,2-diphenylhydrazone Specification

The systematic name of Benzaldehyde,4-[bis(phenylmethyl)amino]-, 2,2-diphenylhydrazone is N,N-dibenzyl-4-[(E)-(diphenylhydrazinylidene)methyl]aniline. With the CAS registry number 85171-94-4, it is also named as 4-(Dibenzylamino)benzaldehyde-N,N-diphenylhydrazone. The product's categories are Electronic; Hole Transporting Materials Photonic and Optical Materials; NLO Chromophores and Intermediates; Non-Linear Optical (NLO) Materials; OLED and PLED Materials; Organic Electronics and Photonics. In addition, its molecular formula is C33H29N3 and its molecular weight is 467.6.

The other characteristics of Benzaldehyde,4-[bis(phenylmethyl)amino]-, 2,2-diphenylhydrazone can be summarized as: (1)ACD/LogP: 7.48; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 9; (6)Polar Surface Area: 18.84 Å2; (7)Index of Refraction: 1.6; (8)Molar Refractivity: 152.86 cm3; (9)Molar Volume: 446.932 cm3; (10)Polarizability: 60.598×10-24cm3; (11)Surface Tension: 42.705 dyne/cm; (12)Density: 1.046 g/cm3; (13)Flash Point: 344.919 °C; (14)Melting Point: 148-152 °C; (15)Enthalpy of Vaporization: 95.376 kJ/mol; (16)Boiling Point: 646.713 °C at 760 mmHg; (17)Vapour Pressure: 0 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: N(/N(c1ccccc1)c2ccccc2)=C\c5ccc(N(Cc3ccccc3)Cc4ccccc4)cc5
(2)InChI: InChI=1/C33H29N3/c1-5-13-29(14-6-1)26-35(27-30-15-7-2-8-16-30)31-23-21-28(22-24-31)25-34-36(32-17-9-3-10-18-32)33-19-11-4-12-20-33/h1-25H,26-27H2/b34-25+
(3)InChIKey: IRKBOPBCDTWDDY-YQCHCMBFBB
(4)Std. InChI: InChI=1S/C33H29N3/c1-5-13-29(14-6-1)26-35(27-30-15-7-2-8-16-30)31-23-21-28(22-24-31)25-34-36(32-17-9-3-10-18-32)33-19-11-4-12-20-33/h1-25H,26-27H2/b34-25+
(5)Std. InChIKey: IRKBOPBCDTWDDY-YQCHCMBFSA-N

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