Chemical Properties of 6-Nitroveratryl alcohol (CAS 1016-58-6)

InChI

InChI=1S/C9H11NO5/c1-14-8-3-6(5-11)7(10(12)13)4-9(8)15-2/h3-4,11H,5H2,1-2H3

InChI Key

WBSCOJBVYHQOFB-UHFFFAOYSA-N

Formula

C9H11NO5

SMILES

COc1cc(CO)c([N+](=O)[O-])cc1OC

Molecular Weight¹

213.19

CAS

1016-58-6

Other Names

• 3,4-Dimethoxy-6-nitrobenzyl alcohol
• Benzenemethanol, 4,5-dimethoxy-2-nitro-

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization 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).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[400.97; 450.46]	J/mol×K	[735.80; 952.44]
Cp,gas	400.97	J/mol×K	735.80	Joback Calculated Property
Cp,gas	410.95	J/mol×K	771.91	Joback Calculated Property
Cp,gas	420.24	J/mol×K	808.01	Joback Calculated Property
Cp,gas	428.85	J/mol×K	844.12	Joback Calculated Property
Cp,gas	436.76	J/mol×K	880.23	Joback Calculated Property
Cp,gas	443.97	J/mol×K	916.34	Joback Calculated Property
Cp,gas	450.46	J/mol×K	952.44	Joback Calculated Property

Similar Compounds

Find more compounds similar to 6-Nitroveratryl alcohol.

Sources

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

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