Chemical Properties of Phenol, 2-[(phenylimino)methyl]-, N-oxide (CAS 20357-59-9)

InChI

InChI=1S/C13H11NO2/c15-13-9-5-4-6-11(13)10-14(16)12-7-2-1-3-8-12/h1-10,15H

InChI Key

ORXOGPXBVINWDG-UHFFFAOYSA-N

Formula

C13H11NO2

SMILES

[O-][N+](=Cc1ccccc1O)c1ccccc1

Molecular Weight¹

213.23

CAS

20357-59-9

Other Names

• Nitrone, «alpha»-(o-hydroxyphenyl)-N-phenyl-
• «alpha»-(o-Hydroxyphenyl)-N-phenylnitrone
• Nitrone, «alpha»-(2-hydroxyphenyl)-N-phenyl-

• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_subH° : Enthalpy of sublimation 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔcH°solid	-6625.10 ± 1.10	kJ/mol	NIST
ΔfH°gas	53.90 ± 2.40	kJ/mol	NIST
ΔfH°solid	-62.60 ± 2.00	kJ/mol	NIST
ΔsubH°	[116.50; 116.50]	kJ/mol
ΔsubH°	116.50 ± 1.40	kJ/mol	NIST
ΔsubH°	116.50 ± 1.40	kJ/mol	NIST
log10WS	-2.78		Crippen Calculated Property
logPoct/wat	2.653		Crippen Calculated Property
McVol	163.930	ml/mol	McGowan Calculated Property

Similar Compounds

Find more compounds similar to Phenol, 2-[(phenylimino)methyl]-, N-oxide.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.