Phenol, 3-methyl-5-(1-methylethyl)-

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

Quantity Value Units Method Reference Comment
Δfgas-50.22kcal/molCcbBertholon, Giray, et al., 1971 

Condensed phase thermochemistry data

Go To: Top, Gas phase thermochemistry data, Phase change data, 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
Δfsolid-72.kcal/molCcbBertholon, Giray, et al., 1971 
Quantity Value Units Method Reference Comment
Δcsolid-1347.kcal/molCcbBertholon, Giray, et al., 1971Corresponding Δfsolid = -72. kcal/mol (simple calculation by NIST; no Washburn corrections)

Phase change data

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, References, Notes

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
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.

Quantity Value Units Method Reference Comment
Tboil514.2KN/AWeast and Grasselli, 1989BS
Tboil514.15KN/AKarr, Estep, et al., 1961Uncertainty assigned by TRC = 4. K; TRC
Tboil514.15KN/AKarr, 1957Uncertainty assigned by TRC = 4. K; TRC
Tboil514.15KN/AWhite, 1954Uncertainty assigned by TRC = 4. K; TRC
Tboil514.15KN/AKnoevenagel, 1894Uncertainty assigned by TRC = 5. K; TRC
Quantity Value Units Method Reference Comment
Tfus327.15KN/AKarr, 1957Uncertainty assigned by TRC = 3. K; TRC
Tfus322.55KN/AHofer and Peebles, 1955Uncertainty assigned by TRC = 2. K; TRC
Tfus321.65KN/AWhite, 1954Uncertainty assigned by TRC = 2. K; TRC
Tfus322.65KN/AHorning, Horning, et al., 1949Uncertainty assigned by TRC = 2. K; TRC
Tfus327.15KN/AKnoevenagel, 1894Uncertainty assigned by TRC = 3. K; TRC
Quantity Value Units Method Reference Comment
Δsub21.78kcal/molCBertholon, Giray, et al., 1971ALS
Δsub21.5kcal/molN/ABertholon, Giray, et al., 1971DRB

Reduced pressure boiling point

Tboil (K) Pressure (atm) Reference Comment
375.70.005Weast and Grasselli, 1989BS

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:


References

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Notes

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

Bertholon, Giray, et al., 1971
Bertholon, G.; Giray, M.; Perrin, R.; Vincent-Falquet-Berny, M.F., No. 532. - Etude physicochimique des phenols. OX. - Ethanlpies de combustion et energies de resonance des alcoyl et aryphenols, Bull. Soc. Chim. France, 1971, 3180-3187. [all data]

Weast and Grasselli, 1989
CRC Handbook of Data on Organic Compounds, 2nd Editon, Weast,R.C and Grasselli, J.G., ed(s)., CRC Press, Inc., Boca Raton, FL, 1989, 1. [all data]

Karr, Estep, et al., 1961
Karr, C.; Estep, P.A.; Chang, T.-C.L.; Comberiati, H.R., , U. S. Bur. Mines, Bull. 591, 1961. [all data]

Karr, 1957
Karr, C., , U. S. Bur. Mines, Inform. Circ. IC 7802, 1957. [all data]

White, 1954
White, E.N., 5th Tar Conf. Coal Tar Res. Assoc. Rept. 0124, 1954, England, 1954. [all data]

Knoevenagel, 1894
Knoevenagel, E., Chem. Ber., 1894, 27, 2347. [all data]

Hofer and Peebles, 1955
Hofer; Peebles, Anal. Chem., 1955, 27, 1852. [all data]

Horning, Horning, et al., 1949
Horning; Horning; Walker, J. Am. Chem. Soc., 1949, 71, 169. [all data]


Notes

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, References