α-Methylstyrene
- Formula: C9H10
- Molecular weight: 118.1757
- IUPAC Standard InChIKey: XYLMUPLGERFSHI-UHFFFAOYSA-N
- CAS Registry Number: 98-83-9
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Other names: Benzene, (1-methylethenyl)-; Styrene, α-methyl-; α-Methylstyrol; β-Phenylpropylene; Isopropenylbenzene; 1-Methyl-1-phenylethylene; 1-Phenyl-1-methylethylene; 1-Propene, 2-phenyl-; 2-Phenyl-1-propene; 2-Phenylpropene; (1-Methylethenyl)benzene; AS-Methylphenylethylene; β-phenylpropene; α-Methylstyreen; α-Metil-stirolo; Isopropenil-benzolo; Isopropenyl-benzeen; Isopropenyl-benzol; 2-Phenylpropylene; UN 2303; Benzene, isopropenyl-; 2-Phenyl-2-propene; 1-Methyl-1-phenylethene; NSC 9400; a-methylstyrene
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Phase change data
Go To: Top, 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 as indicated in comments:
BS - Robert L. Brown and Stephen E. Stein
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos
DH - Eugene S. Domalski and Elizabeth D. Hearing
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 438. ± 4. | K | AVG | N/A | Average of 15 out of 16 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
Tfus | 249.05 | K | N/A | Anonymous, 1952 | Uncertainty assigned by TRC = 0.3 K; TRC |
Tfus | 247.22 | K | N/A | Anonymous, 1946 | Uncertainty assigned by TRC = 0.6 K; TRC |
Tfus | 249.94 | K | N/A | Stull, 1945 | Uncertainty assigned by TRC = 0.25 K; TRC |
Tfus | 244.83 | K | N/A | Anonymous, 1943 | Uncertainty assigned by TRC = 0.4 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Tc | 645. | K | N/A | Steele, Chirico, et al., 1997 | Uncertainty assigned by TRC = 6. K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Pc | 35.04 | atm | N/A | Steele, Chirico, et al., 1997 | Uncertainty assigned by TRC = 2.96 atm; derived from fit of obs. vapor pressure; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ρc | 2.44 | mol/l | N/A | Steele, Chirico, et al., 1997 | Uncertainty assigned by TRC = 0.13 mol/l; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ΔvapH° | 11.7 ± 0.07 | kcal/mol | GS | Verevkin, 1999 | Based on data from 274. to 314. K.; AC |
ΔvapH° | 11.6 ± 0.1 | kcal/mol | EB | Steele, Chirico, et al., 1997, 2 | Based on data from 331. to 467. K.; AC |
Enthalpy of vaporization
ΔvapH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
11.8 ± 0.07 | 294. | GS | Verevkin, 1999 | Based on data from 274. to 314. K.; AC |
11.0 ± 0.07 | 340. | EB | Steele, Chirico, et al., 1997, 2 | Based on data from 331. to 467. K.; AC |
10.3 ± 0.07 | 380. | EB | Steele, Chirico, et al., 1997, 2 | Based on data from 331. to 467. K.; AC |
9.70 ± 0.07 | 420. | EB | Steele, Chirico, et al., 1997, 2 | Based on data from 331. to 467. K.; AC |
9.0 ± 0.1 | 460. | EB | Steele, Chirico, et al., 1997, 2 | Based on data from 331. to 467. K.; AC |
10.6 | 358. | A | Stephenson and Malanowski, 1987 | Based on data from 343. to 493. K.; AC |
10.7 | 368. | A | Stephenson and Malanowski, 1987 | Based on data from 353. to 413. K.; AC |
Antoine Equation Parameters
log10(P) = A − (B / (T + C))
P = vapor pressure (atm)
T = temperature (K)
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Temperature (K) | A | B | C | Reference | Comment |
---|---|---|---|---|---|
280.6 to 438.6 | 5.21396 | 2326.867 | 7.23 | Stull, 1947 | Coefficents calculated by NIST from author's data. |
Enthalpy of fusion
ΔfusH (kcal/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
2.8499 | 250.78 | Lebedev and Rabinovich, 1971 | DH |
2.849 | 250.8 | Domalski and Hearing, 1996 | AC |
Entropy of fusion
ΔfusS (cal/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
11.36 | 250.78 | Lebedev and Rabinovich, 1971 | DH |
IR Spectrum
Go To: Top, Phase change data, 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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Gas Phase Spectrum
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Notice: Concentration information is not available for this spectrum and, therefore, molar absorptivity values cannot be derived.
Additional Data
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Download spectrum in JCAMP-DX format.
Owner | NIST Standard Reference Data Program Collection (C) 2018 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | Sadtler Research Labs Under US-EPA Contract |
State | gas |
Mass spectrum (electron ionization)
Go To: Top, Phase change 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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Additional Data
View image of digitized spectrum (can be printed in landscape orientation).
Due to licensing restrictions, this spectrum cannot be downloaded.
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-2072 |
NIST MS number | 229186 |
References
Go To: Top, Phase change 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.
Anonymous, 1952
Anonymous, R.,
, Physical Properties of Chemical Substances, Dow Chemical Co., 1952. [all data]
Anonymous, 1946
Anonymous, R.,
, Am. Pet. Inst. Res. Proj. 45, Ohio State Univ., 1946. [all data]
Stull, 1945
Stull, D.R.,
Personal Commun., Dow Chemical Co., 1945. [all data]
Anonymous, 1943
Anonymous, R.,
, Sunbury Rep. No. 2176, Anglo-Iranian Oil Co., 1943. [all data]
Steele, Chirico, et al., 1997
Steele, W.V.; Chirico, R.D.; Knipmeyer, S.E.; Nguyen, A.,
Vapor Pressure, Heat Capacity, and Density along the Saturated Line, Measurements for Dimethyl Isophthalate, Dimethyl Carbonate, 1,3,5-Trimethyl benzene, Pentafluorophenol, 4-tert-Butylcatechol, .alp,
J. Chem. Eng. Data, 1997, 42, 1008-20. [all data]
Verevkin, 1999
Verevkin, Sergey P.,
Thermochemical investigation on α-methyl-styrene and parent phenyl substituted alkenes,
Thermochimica Acta, 1999, 326, 1-2, 17-25, https://doi.org/10.1016/S0040-6031(98)00585-1
. [all data]
Steele, Chirico, et al., 1997, 2
Steele, W.V.; Chirico, R.D.; Knipmeyer, S.E.; Nguyen, A.,
Vapor Pressure, Heat Capacity, and Density along the Saturation Line, Measurements for Dimethyl Isophthalate, Dimethyl Carbonate, 1,3,5-Triethylbenzene, Pentafluorophenol, 4- tert -Butylcatechol, α-Methylstyrene, and N , N '-Bis(2-hydroxyethyl)ethylenediamine,
J. Chem. Eng. Data, 1997, 42, 6, 1008-1020, https://doi.org/10.1021/je970102d
. [all data]
Stephenson and Malanowski, 1987
Stephenson, Richard M.; Malanowski, Stanislaw,
Handbook of the Thermodynamics of Organic Compounds, 1987, https://doi.org/10.1007/978-94-009-3173-2
. [all data]
Stull, 1947
Stull, Daniel R.,
Vapor Pressure of Pure Substances. Organic and Inorganic Compounds,
Ind. Eng. Chem., 1947, 39, 4, 517-540, https://doi.org/10.1021/ie50448a022
. [all data]
Lebedev and Rabinovich, 1971
Lebedev, B.V.; Rabinovich, I.B.,
Heat capacities and thermodynamic functions of a-methylstyrene and poly(a-methylstyrene),
Tr. Khim. Khim. Tekhnol., 1971, 1, 12-15. [all data]
Domalski and Hearing, 1996
Domalski, Eugene S.; Hearing, Elizabeth D.,
Heat Capacities and Entropies of Organic Compounds in the Condensed Phase. Volume III,
J. Phys. Chem. Ref. Data, 1996, 25, 1, 1, https://doi.org/10.1063/1.555985
. [all data]
Notes
Go To: Top, Phase change data, IR Spectrum, Mass spectrum (electron ionization), References
- Symbols used in this document:
Pc Critical pressure Tboil Boiling point Tc Critical temperature Tfus Fusion (melting) point ΔfusH Enthalpy of fusion ΔfusS Entropy of fusion ΔvapH Enthalpy of vaporization ΔvapH° Enthalpy of vaporization at standard conditions ρc Critical density - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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