Chemical Properties of Neocuproine (CAS 484-11-7)

InChI

InChI=1S/C14H12N2/c1-9-3-5-11-7-8-12-6-4-10(2)16-14(12)13(11)15-9/h3-8H,1-2H3

InChI Key

IYRGXJIJGHOCFS-UHFFFAOYSA-N

Formula

C14H12N2

SMILES

Cc1ccc2ccc3ccc(C)nc3c2n1

Molecular Weight¹

208.26

CAS

484-11-7

Other Names

• 1,10-Phenanthroline, 2,9-dimethyl-
• 2,9-Dimethyl-o-phenanthroline
• 2,9-Dimethylphenanthroline
• 2,9-dimethyl-1,10-phenanthroline
• Neo-Cuproin

• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Similar Compounds

Find more compounds similar to Neocuproine.

Sources

• Crippen Method
• Crippen Method
• Heat capacities and molar enthalpies and entropies of fusion for anhydrous 1,10-phenanthroline and 2,9-dimethyl-1,10-phenanthroline
• McGowan Method
• NIST Webbook

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