Chemical Properties of Benodanil (CAS 15310-01-7)

InChI

InChI=1S/C13H10INO/c14-12-9-5-4-8-11(12)13(16)15-10-6-2-1-3-7-10/h1-9H,(H,15,16)

InChI Key

LJOZMWRYMKECFF-UHFFFAOYSA-N

Formula

C13H10INO

SMILES

OC(=Nc1ccccc1)c1ccccc1I

Molecular Weight¹

323.13

CAS

15310-01-7

Other Names

• Benzamide, 2-iodo-N-phenyl-
• Benzanilide, 2-iodo-
• 2-Iodobenzanilide
• BAS-3170
• BAS 3170F
• Calirus
• 2-Iodobenzoic acid anilide
• 2-Iodo-N-phenylbenzamide
• Benefit
• NSC 100499

• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Find more compounds similar to Benodanil.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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