Benzene, 1-chloro-3-nitro-
- Formula: C6H4ClNO2
- Molecular weight: 157.554
- IUPAC Standard InChIKey: KMAQZIILEGKYQZ-UHFFFAOYSA-N
- CAS Registry Number: 121-73-3
- 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: m-Chloronitrobenzene; m-Nitrochlorobenzene; 1-Chloro-3-nitrobenzene; 3-Chloro-1-nitrobenzene; Chloro-m-nitrobenzene; 3-Chloronitrobenzene; Nitrochlorobenzene, meta-; Metachloronitrobenzene; NSC 5502
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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
AC - William E. Acree, Jr., James S. Chickos
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 508.7 | K | N/A | Weast and Grasselli, 1989 | BS |
Tboil | 508.65 | K | N/A | Lecat, 1947 | Uncertainty assigned by TRC = 0.6 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Tfus | 317. | K | N/A | Timmermans, 1935 | Uncertainty assigned by TRC = 1.5 K; TRC |
Tfus | 316.3 | K | N/A | Sidgwick and Rubie, 1921 | Uncertainty assigned by TRC = 0.6 K; TRC |
Tfus | 317. | K | N/A | Buechner, 1906 | Uncertainty assigned by TRC = 2. K; TRC |
Tfus | 316.95 | K | N/A | Bruner, 1894 | Uncertainty assigned by TRC = 0.6 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ΔvapH° | 14.4 ± 0.05 | kcal/mol | GS | Verevkin and Schick, 2003 | Based on data from 319. to 364. K.; AC |
Quantity | Value | Units | Method | Reference | Comment |
ΔsubH° | 19.7 ± 0.36 | kcal/mol | C | Ribeiro da Silva, Lobo Ferreira, et al., 2009 | AC |
ΔsubH° | 19.4 ± 0.07 | kcal/mol | GS | Verevkin and Schick, 2003 | Based on data from 281. to 314. K.; AC |
Enthalpy of vaporization
ΔvapH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
12.3 | 429. | EB | Putcha, Ivaturi, et al., 1984 | Based on data from 414. to 506. K.; AC |
Enthalpy of sublimation
ΔsubH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
17.9 ± 0.5 | 281. | V | Wolf and Weghofer, 1938 | ALS |
17.9 ± 0.41 | 275. to 286. | N/A | Trieschmann, 1935 | See also Wolf and Weghofer, 1938, 2.; AC |
Enthalpy of fusion
ΔfusH (kcal/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
4.665 | 316.9 | Straka, Ruzicka, et al., 2007 | AC |
4.457 | 318. | Verevkin and Schick, 2003 | AC |
4.630 | 317.6 | Acree, 1991 | AC |
References
Go To: Top, Phase change data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
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]
Lecat, 1947
Lecat, M.,
Some azeotropes of which one constituant is heterocyclic nitrogen,
Ann. Soc. Sci. Bruxelles, Ser. 1, 1947, 61, 73. [all data]
Timmermans, 1935
Timmermans, J.,
Researches in Stoichiometry. I. The Heat of Fusion of Organic Compounds.,
Bull. Soc. Chim. Belg., 1935, 44, 17-40. [all data]
Sidgwick and Rubie, 1921
Sidgwick, N.V.; Rubie, H.E.,
The solubility and volatility of the chloro- and nitro-anilines and of their acetyl derivatives,
J. Chem. Soc., 1921, 119, 1013-24. [all data]
Buechner, 1906
Buechner, E.H.,
Z. Phys. Chem., Stoechiom. Verwandtschaftsl., 1906, 54, 665. [all data]
Bruner, 1894
Bruner, L.,
The heats of fusion of some organic compounds,
Ber. Dtsch. Chem. Ges., 1894, 27, 2102. [all data]
Verevkin and Schick, 2003
Verevkin, Sergey P.; Schick, Christoph,
Determination of vapor pressures, enthalpies of sublimation, enthalpies of vaporization, and enthalpies of fusion of a series of chloro-aminobenzenes and chloro-nitrobenzenes,
Fluid Phase Equilibria, 2003, 211, 2, 161-177, https://doi.org/10.1016/S0378-3812(03)00181-X
. [all data]
Ribeiro da Silva, Lobo Ferreira, et al., 2009
Ribeiro da Silva, Manuel A.V.; Lobo Ferreira, Ana I.M.C.; Moreno, Ana Rita G.,
Experimental thermochemical study of the monochloronitrobenzene isomers,
The Journal of Chemical Thermodynamics, 2009, 41, 1, 109-114, https://doi.org/10.1016/j.jct.2008.07.012
. [all data]
Putcha, Ivaturi, et al., 1984
Putcha, Sivaram; Ivaturi, Rao V.; Machiraju, Ramakrishna,
Vapor pressures of o-and m-nitrochlorobenzene,
J. Chem. Eng. Data, 1984, 29, 2, 135-136, https://doi.org/10.1021/je00036a011
. [all data]
Wolf and Weghofer, 1938
Wolf, K.L.; Weghofer, H.,
Uber sublimationswarmen,
Z. Phys. Chem., 1938, 39, 194-208. [all data]
Trieschmann, 1935
Trieschmann, H.G.,
, Ph.D. Dissertation, Inst. Fur Phys. Chem. and Electrochem. der Universitat Kiel, Germany, 1935. [all data]
Wolf and Weghofer, 1938, 2
Wolf, K.L.; Weghofer, H.Z.,
Z. Phys. Chem. Abt. B, 1938, 39, 194. [all data]
Straka, Ruzicka, et al., 2007
Straka, Martin; Ruzicka, Kvetoslav; Ruzicka, Vlastimil,
Heat Capacities of Chloroanilines and Chloronitrobenzenes,
J. Chem. Eng. Data, 2007, 52, 4, 1375-1380, https://doi.org/10.1021/je700080k
. [all data]
Acree, 1991
Acree, William E.,
Thermodynamic properties of organic compounds: enthalpy of fusion and melting point temperature compilation,
Thermochimica Acta, 1991, 189, 1, 37-56, https://doi.org/10.1016/0040-6031(91)87098-H
. [all data]
Notes
Go To: Top, Phase change data, References
- Symbols used in this document:
Tboil Boiling point Tfus Fusion (melting) point ΔfusH Enthalpy of fusion ΔsubH Enthalpy of sublimation ΔsubH° Enthalpy of sublimation at standard conditions ΔvapH Enthalpy of vaporization ΔvapH° Enthalpy of vaporization at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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