Chemical Properties of Mephenesin (CAS 59-47-2)

InChI

InChI=1S/C10H14O3/c1-8-4-2-3-5-10(8)13-7-9(12)6-11/h2-5,9,11-12H,6-7H2,1H3

InChI Key

JWDYCNIAQWPBHD-UHFFFAOYSA-N

Formula

C10H14O3

SMILES

Cc1ccccc1OCC(O)CO

Molecular Weight¹

182.22

CAS

59-47-2

Other Names

• (+/-)-Mephenesin
• 1,2-Dihydroxy-3-(2-methylphenoxy)propane
• 1,2-Propanediol, 3-(2-methylphenoxy)-
• 1,2-Propanediol, 3-(o-tolyloxy)-
• 1-Ortho-tolylglycerol ether
• 1-o-Tolylglycerol ether
• 3-(2-Methylphenoxy)propane-1,2-diol
• 3-(2-Tolyloxy)-1,2-propanediol
• 3-(2-methylphenoxy)-1,2-propanediol
• 3-(o-Methylphenoxy)-1,2-propanediol
• 3-(o-Tolyloxy)-1,2-propanediol
• 3-(o-Tolyloxy)propane-1,2-diol
• 3-o-Toloxy-1,2-propanediol
• A 1141
• Ageflex CGE
• Anatensin
• Anxine
• Atensin
• Avesyl
• Avosyl
• Avoxil
• Avoxyl
• BDH 312
• BYK-M 1
• Cresodiol
• Cresossidiolo
• Cresossipropandiolo
• Cresoxydiol
• Cresoxypropanediol
• Curaril
• Curarythan
• Curythan
• Daserd
• Daserol
• Decontractil
• Decontractyl
• Diloxol
• Dioloxal
• Dioloxol
• Findolar
• Findolor
• Glukresin
• Glyceryl o-Tolyl ether
• Glykresin
• Glyotol
• Glytol
• Halabar
• Kinavosyl
• Kresoxypropandiol
• Lissenphan
• Lissephen
• Mc 2303
• Mefenesina
• Mefensina
• Memphenesin
• Mephate
• Mephedan
• Mephelor
• Mephenesine
• Mepherol
• Mephesin
• Mephin
• Mephosal
• Mephson
• Mervaldin
• Mianesina
• Miolisina
• Moctynol
• Myanesin
• Myanil
• Myanol
• Myasin
• Myastenin
• Mycocuran
• Myocaine
• Myocuran
• Myodetensin
• Myodetensine
• Myolax
• Myolysin
• Myopan
• Myopen
• Myopna
• Myosera
• Myoserol
• Myoten
• Myoxane
• Myoxyl
• Nembusen
• Nephelor
• Noctynol
• Oranixon
• Oronixon
• Ortol
• Prolax
• Prolaxin
• Proloxin
• RP 3602
• Relaxant
• Relaxar
• Relaxil
• Relaxyl
• Renarcol
• Rex regulans
• Rhex
• Rhex 'hobeino'
• Rhex regulans
• SQ 1156
• Sansdolor
• Saserol
• Seconesinz
• Sinan
• Spartoloxin
• Spartoloxyn
• Spasmolyn
• Stilalgin
• Temian
• Thioxidil
• Thoxidil
• Tokerol
• Tolansin
• Tolax
• Tolbart
• Tolcil
• Tolhart
• Tolofren
• Tolosate
• Toloxyn
• Tolserol
• Tolseron
• Tolsil
• Tolsin
• Tolulexin
• Tolulox
• Tolydrin
• Tolynol
• Tolyspaz
• Torulox
• Vitamisin
• Vitascorbol
• Walconesin
• Walko-Nesin
• Xeral
• Xitix
• component of Tolagesic
• mephensin
• o-Cresol glyceryl ether
• o-Cresyl glycerol ether
• o-Cresyl «alpha»-glyceryl ether
• o-Kresol-glycerinaether
• «alpha»,«beta»-Dihydroxy-«gamma»-(2-methylphenoxy)propane
• «alpha»-(o-Tolyl)glyceryl ether

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	29.80	kJ/mol	Study of Glass Transition Phenomena in the Supercooled Liquid Phase of Methocarbamol, Acetaminophen and Mephensin
IE	8.64	eV	Relay (1.0) Calculated Property
log10WS	-1.19		Aq. Solubility Prediction
logPoct/wat	0.727		Crippen Calculated Property
McVol	145.610	ml/mol	McGowan Calculated Property
Inp	[1518.00; 1586.10]
Inp	1533.00		NIST
Inp	1531.00		NIST
Inp	1518.00		NIST
Inp	1540.00		NIST
Inp	1586.10		NIST
Inp	1545.00		NIST
Inp	1568.00		NIST
Inp	1518.00		NIST
Tboil	593.10	K	Relay (1.0) Calculated Property
Tc	811.58	K	Relay (1.0) Calculated Property
Tfus	331.85	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[386.41; 440.09]	J/mol×K	[666.40; 852.68]
Cp,gas	386.41	J/mol×K	666.40	Joback Calculated Property
Cp,gas	396.68	J/mol×K	697.45	Joback Calculated Property
Cp,gas	406.41	J/mol×K	728.49	Joback Calculated Property
Cp,gas	415.61	J/mol×K	759.54	Joback Calculated Property
Cp,gas	424.27	J/mol×K	790.59	Joback Calculated Property
Cp,gas	432.43	J/mol×K	821.63	Joback Calculated Property
Cp,gas	440.09	J/mol×K	852.68	Joback Calculated Property
η	[0.0000143; 0.0047133]	Pa×s	[370.27; 666.40]
η	0.0047133	Pa×s	370.27	Joback Calculated Property
η	0.0010152	Pa×s	419.62	Joback Calculated Property
η	0.0003021	Pa×s	468.98	Joback Calculated Property
η	0.0001132	Pa×s	518.34	Joback Calculated Property
η	0.0000503	Pa×s	567.69	Joback Calculated Property
η	0.0000255	Pa×s	617.04	Joback Calculated Property
η	0.0000143	Pa×s	666.40	Joback Calculated Property

Pressure Dependent Properties

Similar Compounds

Find more compounds similar to Mephenesin.

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
• Study of Glass Transition Phenomena in the Supercooled Liquid Phase of Methocarbamol, Acetaminophen and Mephensin
• Joback Method
• Aqueous Solubility Prediction 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.
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