Chemical Properties of 6-Chloro-4-chromanone (CAS 37674-72-9)

InChI

InChI=1S/C9H7ClO2/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-2,5H,3-4H2

InChI Key

LLTDYHFVIVSQPJ-UHFFFAOYSA-N

Formula

C12H16

SMILES

O=C1CCOc2ccc(Cl)cc21

Molecular Weight¹

160.26

CAS

37674-72-9

Other Names

• 4H-1-Benzopyran-4-one, 6-chloro-2,3-dihydro-
• 6-chlorochroman-4-one

• 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	[274.73; 337.13]	J/mol×K	[589.84; 846.40]
Cp,gas	274.73	J/mol×K	589.84	Joback Calculated Property
Cp,gas	287.30	J/mol×K	632.60	Joback Calculated Property
Cp,gas	298.97	J/mol×K	675.36	Joback Calculated Property
Cp,gas	309.76	J/mol×K	718.12	Joback Calculated Property
Cp,gas	319.70	J/mol×K	760.88	Joback Calculated Property
Cp,gas	328.82	J/mol×K	803.64	Joback Calculated Property
Cp,gas	337.13	J/mol×K	846.40	Joback Calculated Property

Similar Compounds

Find more compounds similar to 6-Chloro-4-chromanone.

Sources

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

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