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Oxirane, (phenoxymethyl)-

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Gas phase thermochemistry data

Go To: Top, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, IR Spectrum, Mass spectrum (electron ionization), References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Quantity Value Units Method Reference Comment
Deltafgas-99.7 ± 1.1kJ/molCcbSteele, Chirico, et al., 1997 
Deltafgas-116.4 ± 2.1kJ/molCcbVan-Chin-Syan and Kachurina, 1987 
Deltafgas-116. ± 2.kJ/molCcbKuznetsova, Miroshnichenko, et al., 1976 

Condensed phase thermochemistry data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments:
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing

Quantity Value Units Method Reference Comment
Deltafliquid-169.53 ± 0.78kJ/molCcbSteele, Chirico, et al., 1997ALS
Deltafliquid-182. ± 2.kJ/molCcbKuznetsova, Miroshnichenko, et al., 1976ALS
Quantity Value Units Method Reference Comment
Deltacliquid-4801.21 ± 0.64kJ/molCcbSteele, Chirico, et al., 1997Corresponding «DELTA»fliquid = -169.53 kJ/mol (simple calculation by NIST; no Washburn corrections); ALS
Deltacliquid-4785. ± 2.kJ/molCcbKuznetsova, Miroshnichenko, et al., 1976Corresponding «DELTA»fliquid = -186. kJ/mol (simple calculation by NIST; no Washburn corrections); ALS
Quantity Value Units Method Reference Comment
liquid274.9J/mol*KN/ALebedev, Bykova, et al., 1988DH

Constant pressure heat capacity of liquid

Cp,liquid (J/mol*K) Temperature (K) Reference Comment
276.0298.15Lebedev, Bykova, et al., 1988T = 5 to 330 K.; DH

Constant pressure heat capacity of solid

Cp,solid (J/mol*K) Temperature (K) Reference Comment
278.7298.Lesbats and Lichanot, 1987T = 225 to 400 K.; DH

Phase change data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments:
BS - Robert L. Brown and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny, director
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DRB - Donald R. Burgess, Jr.
AC - William E. Acree, Jr., James S. Chickos

Quantity Value Units Method Reference Comment
Tboil518.2KN/AAldrich Chemical Company Inc., 1990BS
Quantity Value Units Method Reference Comment
Tfus276.79KN/ALebedev, Bykova, et al., 1988DH
Quantity Value Units Method Reference Comment
Ttriple280.KN/ALebedev, Bykova, et al., 1988, 2Uncertainty assigned by TRC = 0.1 K; TRC
Quantity Value Units Method Reference Comment
Tc720.KN/ASteele, Chirico, et al., 1997, 2Uncertainty assigned by TRC = 8. K; TRC
Quantity Value Units Method Reference Comment
Pc29.50barN/ASteele, Chirico, et al., 1997, 2Uncertainty assigned by TRC = 4.00 bar; derived from fit of obs. vapor pressure; TRC
Quantity Value Units Method Reference Comment
rhoc2.16mol/lN/ASteele, Chirico, et al., 1997, 2Uncertainty assigned by TRC = 0.13 mol/l; TRC
Quantity Value Units Method Reference Comment
Deltavap69.85kJ/molVSteele, Chirico, et al., 1997ALS
Deltavap69.8kJ/molN/ASteele, Chirico, et al., 1997DRB
Deltavap69.9 ± 0.7kJ/molEBSteele, Chirico, et al., 1997, 3Based on data from 400. - 532. K.; AC
Deltavap65.6 ± 0.1kJ/molVVan-Chin-Syan and Kachurina, 1987ALS
Deltavap66.0kJ/molN/AKuznetsova, Miroshnichenko, et al., 1976DRB

Enthalpy of vaporization

DeltavapH (kJ/mol) Temperature (K) Method Reference Comment
60.3 ± 0.5400.EBSteele, Chirico, et al., 1997, 3Based on data from 400. - 532. K.; AC
56.7 ± 0.4440.EBSteele, Chirico, et al., 1997, 3Based on data from 400. - 532. K.; AC
53.1 ± 0.4480.EBSteele, Chirico, et al., 1997, 3Based on data from 400. - 532. K.; AC
51.3 ± 0.5500.EBSteele, Chirico, et al., 1997, 3Based on data from 400. - 532. K.; AC
49.4 ± 0.6520.EBSteele, Chirico, et al., 1997, 3Based on data from 400. - 532. K.; AC
65.6 ± 0.1343. - 373.N/AKuznetsova, Miroshinichenko, et al., 1976AC
65.61 ± 0.08343.VKuznetsova, Miroshnichenko, et al., 1976ALS

Enthalpy of fusion

DeltafusH (kJ/mol) Temperature (K) Reference Comment
17.32279.8Lebedev, Bykova, et al., 1988, 3AC

In addition to the Thermodynamics Research Center (TRC) data available from this site, much more physical and chemical property data is available from the following TRC products:


Reaction thermochemistry data

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, IR Spectrum, Mass spectrum (electron ionization), References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.

Individual Reactions

2-Propanol, 1-phenoxy-3-(phenylamino)- = Oxirane, (phenoxymethyl)- + Aniline

By formula: C15H17NO2 = C9H10O2 + C6H7N

Quantity Value Units Method Reference Comment
Deltar113. ± 2.kJ/molCmKuznetsova, Rakova, et al., 1975solid phase; solvent: DMF

Benzene, isocyanato- + Oxirane, (phenoxymethyl)- = 5-Phenoxymethyl-3-phenyl-2-oxazolidone

By formula: C7H5NO + C9H10O2 = C16H15NO3

Quantity Value Units Method Reference Comment
Deltar-196.7kJ/molCmLebedev, Bykova, et al., 1988, 4liquid phase

IR Spectrum

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Mass spectrum (electron ionization), References, Notes

Data compiled by: Coblentz Society, Inc.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director


Mass spectrum (electron ionization)

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, IR Spectrum, References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Spectrum

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Mass spectrum
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Additional Data

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Owner NIST Mass Spectrometry Data Center
Collection (C) 2014 copyright by the U.S. Secretary of Commerce
on behalf of the United States of America. All rights reserved.
Origin Japan AIST/NIMC Database- Spectrum MS-NW- 545
NIST MS number 227902

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References

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, IR Spectrum, Mass spectrum (electron ionization), Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Steele, Chirico, et al., 1997
Steele, W.V.; Chirico, R.D.; Cowell, A.B.; Knipmeyer, S.E.; Nguyen, A., Thermodynamic properties and ideal-gas enthalpies of formation for 2-aminoisobutyric acid (2-methylalanine), acetic acid, (4-methyl-3-penten-2-one), 4-methylpent-1-ene, 2,2'-bis(phenylthio)propane, and glycidyl phenyl ether (1,2-epoxy-3-phenoxypropane), J. Chem. Eng. Data, 1997, 42, 1052-1066. [all data]

Van-Chin-Syan and Kachurina, 1987
Van-Chin-Syan, Yu.Ya.; Kachurina, N.S., Thermochemical properties of oxirane derivatives, Russ. J. Phys. Chem. (Engl. Transl.), 1987, 61, 622-624. [all data]

Kuznetsova, Miroshnichenko, et al., 1976
Kuznetsova, V.P.; Miroshnichenko, E.A.; Zelenetskii, A.N.; Rakova, G.V.; Lebedev, Yu.A.; Enikolopyan, N.S., Enthalpies of reactions of epoxides with primary amines, Dokl. Phys. Chem. (Engl. Transl.), 1976, 226, 147-150, In original 1109. [all data]

Lebedev, Bykova, et al., 1988
Lebedev, B.V.; Bykova, T.A.; Kiparisova, Y.G.; Frenkel, Ts.M.; Fainleib, A.M.; Pankratov, V.A., Thermodynamics of phenyl glycidyl ether and its reactions with diphenylcarbodiimide and phenyl isocyanate with the formation of iminooxazolidinone and oxazolidinone in the range 0-330 K, Izvest. Akad. Nauk SSSR, Ser. Khim., 1988, (6), 1232-1237. [all data]

Lesbats and Lichanot, 1987
Lesbats, C.; Lichanot, A., Capacites calorifiques de durcisseurs amines et resines epoxydes, Thermochim. Acta, 1987, 109, 317-329. [all data]

Aldrich Chemical Company Inc., 1990
Aldrich Chemical Company Inc., Catalog Handbook of Fine Chemicals, Aldrich Chemical Company, Inc., Milwaukee WI, 1990, 1. [all data]

Lebedev, Bykova, et al., 1988, 2
Lebedev, B.V.; Bykova, T.A.; Kiparisova, E.G.; Frenkel, Ts.M.; Fainleib, A.M.; Pankratov, V.A., Bull. Acad. Sci. USSR, Div. Chem. Sci. (Eng. Tran.), 1988, 37. [all data]

Steele, Chirico, et al., 1997, 2
Steele, W.V.; Chirico, R.D.; Cowell, A.B.; Knipmeyer, S.E.; Nguyen, A., Thermodynamic Properties and Ideal-Gas Enthalpies of FOrmation for 2-Aminoisobutyric Acid (2-Methylalanine), Acetic Acid, (Z)-5-Ethylidene-2- norbornene, Mesityl Oxide (4-Methyl-3-pentene-2-one), 4-M, J. Chem. Eng. Data, 1997, 42, 1053-66. [all data]

Steele, Chirico, et al., 1997, 3
Steele, W.V.; Chirico, R.D.; Cowell, A.B.; Knipmeyer, S.E.; Nguyen, A., Thermodynamic Properties and Ideal-Gas Enthalpies of Formation for 2-Aminoisobutyric Acid (2-Methylalanine), Acetic Acid, ( Z )-5-Ethylidene-2-norbornene, Mesityl Oxide (4-Methyl-3-penten-2-one), 4-Methylpent-1-ene, 2,2'-Bis(phenylthio)propane, and Glycidyl Phenyl Ether (1,2-Epoxy-3-phenoxypropane), J. Chem. Eng. Data, 1997, 42, 6, 1053-1066, https://doi.org/10.1021/je970099y . [all data]

Kuznetsova, Miroshinichenko, et al., 1976
Kuznetsova, V.P.; Miroshinichenko, E.A.; Zelenetskii, A.Z.; Rokova, G.V.; Lebedev, Y.A.; Enikolopyan, N.S., Dokl. Phys. Chem., 1976, 226, 147. [all data]

Lebedev, Bykova, et al., 1988, 3
Lebedev, B.V.; Bykova, T.A.; Kiparisova, E.G.; Frenkel', Ts.M.; Fainleib, A.M.; Pankratov, V.A., Thermodynamics of phenyl glycidyl ether and its reactions with diphenylcarbodiimide and phenyl isocyanate with the formation of iminooxazolidine and oxazolidinone in the 0?330 K range, Russ Chem Bull, 1988, 37, 6, 1082-1086, https://doi.org/10.1007/BF00961904 . [all data]

Kuznetsova, Rakova, et al., 1975
Kuznetsova, V.P.; Rakova, G.V.; Miroshnichenko, E.A.; Lebedev, Yu.A.; Enikolopyan, N.S., Thermochemical study of the interaction of epoxy compounds with primary amines, Dokl. Phys. Chem. (Engl. Transl.), 1975, 225, 1231-1234. [all data]

Lebedev, Bykova, et al., 1988, 4
Lebedev, B.V.; Bykova, T.A.; Kiparisova, E.G.; Frenkel, Ts.M.; Fainleib, A.M.; Pankratov, V.A., Thermodynamics of phenyl glycidyl ether and its reactions with diphenylcarbodiimide and phenyl isocyanate with the formation of iminooxazolidine and oxazolidinone in the 0-330 K range, Bull. Acad. Sci. USSR, Div. Chem. Sci., 1988, 1082-10. [all data]


Notes

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, IR Spectrum, Mass spectrum (electron ionization), References