Chemical Properties of Benzoic acid, 2-hydroxy-, 2-propenyl ester (CAS 10484-09-0)

InChI

InChI=1S/C10H10O3/c1-2-7-13-10(12)8-5-3-4-6-9(8)11/h2-6,11H,1,7H2

InChI Key

YYKBLDCLPBWOOE-UHFFFAOYSA-N

Formula

C10H10O3

SMILES

C=CCOC(=O)c1ccccc1O

Molecular Weight¹

178.18

CAS

10484-09-0

Other Names

• Salicylic acid, allyl ester
• Allyl salicylate

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• 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

Property	Value	Unit	Source
ΔfG°	-154.97	kJ/mol	Joback Calculated Property
ΔfH°gas	-309.88	kJ/mol	Joback Calculated Property
ΔfusH°	22.99	kJ/mol	Joback Calculated Property
ΔvapH°	61.63	kJ/mol	Joback Calculated Property
log10WS	-1.95		Crippen Calculated Property
logPoct/wat	1.735		Crippen Calculated Property
McVol	137.010	ml/mol	McGowan Calculated Property
Pc	3857.88	kPa	Joback Calculated Property
Inp	1339.00		NIST
I	[1946.00; 1946.00]
I	1946.00		NIST
I	1946.00		NIST
Tboil	608.47	K	Joback Calculated Property
Tc	836.63	K	Joback Calculated Property
Tfus	411.00	K	Joback Calculated Property
Vc	0.459	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[329.63; 387.29]	J/mol×K	[608.47; 836.63]
Cp,gas	329.63	J/mol×K	608.47	Joback Calculated Property
Cp,gas	340.98	J/mol×K	646.50	Joback Calculated Property
Cp,gas	351.54	J/mol×K	684.52	Joback Calculated Property
Cp,gas	361.38	J/mol×K	722.55	Joback Calculated Property
Cp,gas	370.57	J/mol×K	760.58	Joback Calculated Property
Cp,gas	379.18	J/mol×K	798.60	Joback Calculated Property
Cp,gas	387.29	J/mol×K	836.63	Joback Calculated Property
η	[0.0000339; 0.0008638]	Pa×s	[411.00; 608.47]
η	0.0008638	Pa×s	411.00	Joback Calculated Property
η	0.0004122	Pa×s	443.91	Joback Calculated Property
η	0.0002178	Pa×s	476.82	Joback Calculated Property
η	0.0001250	Pa×s	509.74	Joback Calculated Property
η	0.0000767	Pa×s	542.65	Joback Calculated Property
η	0.0000498	Pa×s	575.56	Joback Calculated Property
η	0.0000339	Pa×s	608.47	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzoic acid, 2-hydroxy-, 2-propenyl ester.

Sources

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

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