1,1'-Biphenyl, 2-methyl-
- Formula: C13H12
- Molecular weight: 168.2344
- IUPAC Standard InChIKey: ALLIZEAXNXSFGD-UHFFFAOYSA-N
- CAS Registry Number: 643-58-3
- 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: Biphenyl, 2-methyl-; o-Methylbiphenyl; 2-Methyl-1,1'-biphenyl; 2-Methylbiphenyl; 2-Phenyltoluene; o-Phenyltoluene; 1-Methyl-2-phenylbenzene; 2-Methyldiphenyl
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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 |
---|---|---|---|---|---|
ΔfH°gas | 152.8 ± 1.5 | kJ/mol | Ccb | Steele, Chirico, et al., 1995 |
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 by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°liquid | 86.5 ± 1.3 | kJ/mol | Ccb | Steele, Chirico, et al., 1995 | |
Quantity | Value | Units | Method | Reference | Comment |
ΔcH°liquid | -6917.1 ± 1.2 | kJ/mol | Ccb | Steele, Chirico, et al., 1995 | Corresponding ΔfHºliquid = 86.5 kJ/mol (simple calculation by NIST; no Washburn corrections) |
ΔcH°liquid | -6950.9 | kJ/mol | Ccb | Wise, Serijan, et al., 1951 | Corresponding ΔfHºliquid = 120. kJ/mol (simple calculation by NIST; no Washburn corrections) |
ΔcH°liquid | -6694. | kJ/mol | Ccb | Goodman and Wise, 1950 | Corresponding ΔfHºliquid = -140. kJ/mol (simple calculation by NIST; no Washburn corrections) |
ΔcH°liquid | -6938.7 ± 7.1 | kJ/mol | Ccb | Brull, 1935 | Reanalyzed by Cox and Pilcher, 1970, Original value = -6937.57 kJ/mol; Corresponding ΔfHºliquid = 108.2 kJ/mol (simple calculation by NIST; no Washburn corrections) |
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
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 |
---|---|---|---|---|---|
Tboil | 532. ± 7. | K | AVG | N/A | Average of 12 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
Tfus | 272.95 | K | N/A | Goodman and Wise, 1951 | Uncertainty assigned by TRC = 0.15 K; TRC |
Tfus | 418. | K | N/A | Cook, Dickson, et al., 1950 | TRC |
Tfus | 272.95 | K | N/A | Goodman and Wise, 1950, 2 | Uncertainty assigned by TRC = 0.1 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ΔvapH° | 66.3 ± 0.5 | kJ/mol | V | Steele, Chirico, et al., 1995 | ALS |
ΔvapH° | 66.3 | kJ/mol | N/A | Steele, Chirico, et al., 1995 | DRB |
IR Spectrum
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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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Gas Phase Spectrum
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Additional Data
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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 | NIST Mass Spectrometry Data Center |
State | gas |
Instrument | HP-GC/MS/IRD |
Mass spectrum (electron ionization)
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, IR Spectrum, UV/Visible 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
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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. |
---|---|
NIST MS number | 6409 |
UV/Visible spectrum
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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: Victor Talrose, Eugeny B. Stern, Antonina A. Goncharova, Natalia A. Messineva, Natalia V. Trusova, Margarita V. Efimkina
Spectrum
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Additional Data
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Source | Friedel, Orchin, et al., 1948 |
---|---|
Owner | INEP CP RAS, NIST OSRD Collection (C) 2007 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
Origin | INSTITUTE OF ENERGY PROBLEMS OF CHEMICAL PHYSICS, RAS |
Source reference | RAS UV No. 660 |
Instrument | Beckman spectrophotometer |
Melting point | -0.2 |
Boiling point | 255.5 |
References
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, IR Spectrum, Mass spectrum (electron ionization), UV/Visible spectrum, 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., 1995
Steele, W.V.; Chirico, R.D.; Smith, N.K.,
The standard enthalpies of formation of 2-methylbiphenyl and diphenylmethane,
J. Chem. Thermodyn., 1995, 27, 671-678. [all data]
Wise, Serijan, et al., 1951
Wise, C.H.; Serijan, K.T.; Goodman, I.A.,
NACA Technical Report 1003,
NACA Technical Report 1003, 1951, 1-10. [all data]
Goodman and Wise, 1950
Goodman, I.A.; Wise, P.H.,
Dicyclic hydrocarbons. I. 2-Aklylbiphenyls,
J. Am. Chem. Soc., 1950, 72, 3076-3078. [all data]
Brull, 1935
Brull, L.,
Sui calori di combustione di alcuni derivati del bifenil,
Gazz. Chim. Ital., 1935, 65, 19-28. [all data]
Cox and Pilcher, 1970
Cox, J.D.; Pilcher, G.,
Thermochemistry of Organic and Organometallic Compounds, Academic Press, New York, 1970, 1-636. [all data]
Goodman and Wise, 1951
Goodman, I.A.; Wise, P.H.,
Synthesis & purification of some alkylbiphenyls & alkylbicyclohexyls., Natl. Advis. Comm. Aeronaut., Tech. Note NACA TN 2260, Lewis Flight Propulsion Lab., Cleveland, Ohio, 1951. [all data]
Cook, Dickson, et al., 1950
Cook, J.W.; Dickson, G.T.; Jack, J.; Loudon, J.D.; McKeown, J.; MacMillan, J.; Williamson, W.F.,
Colchicine and Related Compounds,
J. Chem. Soc., 1950, 139. [all data]
Goodman and Wise, 1950, 2
Goodman, I.A.; Wise, P.H.,
Dicycloic Hydrocarbons I. 2-Alkylbiphenyls,
J. Am. Chem. Soc., 1950, 72, 3076. [all data]
Friedel, Orchin, et al., 1948
Friedel, R.A.; Orchin, M.; Reggel, L.,
Steric hindrance and short wave length bands in the ultraviolet spectra of some naphthalene and diphenyl derivatives,
J. Am. Chem. Soc., 1948, 70, 199-204. [all data]
Notes
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, IR Spectrum, Mass spectrum (electron ionization), UV/Visible spectrum, References
- Symbols used in this document:
Tboil Boiling point Tfus Fusion (melting) point ΔcH°liquid Enthalpy of combustion of liquid at standard conditions ΔfH°gas Enthalpy of formation of gas at standard conditions ΔfH°liquid Enthalpy of formation of liquid at standard conditions ΔvapH° Enthalpy of vaporization at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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