Cyclopropane, propyl-
- Formula: C6H12
- Molecular weight: 84.1595
- IUPAC Standard InChI: InChI=1S/C6H12/c1-2-3-6-4-5-6/h6H,2-5H2,1H3
- IUPAC Standard InChIKey: MWVPQZRIWVPJCA-UHFFFAOYSA-N
- CAS Registry Number: 2415-72-7
- 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: Propane, 1-cyclopropyl-; Propylcyclopropane
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Condensed phase thermochemistry data
Go To: Top, Phase change data, Gas Chromatography, 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 |
|---|---|---|---|---|---|
| ΔcH°liquid | -900. | kcal/mol | Ccb | Slabey and Wise, 1952 | Corresponding ΔfHºliquid = -74. kcal/mol (simple calculation by NIST; no Washburn corrections) |
Phase change data
Go To: Top, Condensed phase thermochemistry data, Gas Chromatography, 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: Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| Tboil | 342.30 | K | N/A | Gragson, Greenlee, et al., 1955 | Uncertainty assigned by TRC = 0.5 K |
| Tboil | 342.65 | K | N/A | Pines, Huntsman, et al., 1953 | Uncertainty assigned by TRC = 1.5 K |
| Tboil | 341.65 | K | N/A | Boeseken and Takes, 1937 | Uncertainty assigned by TRC = 1. K |
Gas Chromatography
Go To: Top, Condensed 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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Kovats' RI, non-polar column, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Packed | Squalane | 20. | 609. | Bogoslovsky, Anvaer, et al., 1978 | |
| Packed | Squalane | 80. | 615. | Bogoslovsky, Anvaer, et al., 1978 | |
| Capillary | Squalane | 120. | 608.9 | Schomburg and Dielmann, 1973 | Column length: 100. m; Column diameter: 0.25 mm |
| Capillary | Squalane | 80. | 614.8 | Schomburg and Dielmann, 1973 | Column length: 100. m; Column diameter: 0.25 mm |
Normal alkane RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | Squalane | 609. | Chen, 2008 | Program: not specified |
References
Go To: Top, Condensed phase thermochemistry data, Phase change data, Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Slabey and Wise, 1952
Slabey, V.A.; Wise, P.H.,
Hydrogenation of 2-cyclopropyl-1- and -2-alkenes. Isolation and Purification of 2-cyclopropylalkanes,
J. Am. Chem. Soc., 1952, 74, 3887-3889. [all data]
Gragson, Greenlee, et al., 1955
Gragson, J.T.; Greenlee, K.W.; Derfer, J.M.; Boord, C.E.,
Cyclopropane Hydrocarbons from γ-Bromo Ethers,
J. Org. Chem., 1955, 20, 275. [all data]
Pines, Huntsman, et al., 1953
Pines, H.; Huntsman, W.D.; Ipatieff, V.N.,
J. Am. Chem. Soc., 1953, 75, 2311-5. [all data]
Boeseken and Takes, 1937
Boeseken, J.; Takes, H.V.,
The dielectric moment of a monosubstituted derivattive of cyclopropane (propylcyclopropane).,
Recl. Trav. Chim. Pays-Bas, 1937, 56, 858. [all data]
Bogoslovsky, Anvaer, et al., 1978
Bogoslovsky, Yu.N.; Anvaer, B.I.; Vigdergauz, M.S.,
Chromatographic constants in gas chromatography (in Russian), Standards Publ. House, Moscow, 1978, 192. [all data]
Schomburg and Dielmann, 1973
Schomburg, G.; Dielmann, G.,
Use of retention increments for identification and correlation of saturated and unsaturated cyclopropane hydrocarbons by means of Kovats indices,
Anal. Chem., 1973, 45, 9, 1647-1658, https://doi.org/10.1021/ac60331a021
. [all data]
Chen, 2008
Chen, H.-F.,
Quantitative prediction of gas chromatography retention indices with support vector machines, radial basis neutral networks and multiple linear regression,
Anal. Chim. Acta, 2008, 609, 1, 24-36, https://doi.org/10.1016/j.aca.2008.01.003
. [all data]
Notes
Go To: Top, Condensed phase thermochemistry data, Phase change data, Gas Chromatography, References
- Symbols used in this document:
Tboil Boiling point ΔcH°liquid Enthalpy of combustion of liquid at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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