3-Octene, (Z)-
- Formula: C8H16
- Molecular weight: 112.2126
- IUPAC Standard InChIKey: YCTDZYMMFQCTEO-ALCCZGGFSA-N
- CAS Registry Number: 14850-22-7
- 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. - Stereoisomers:
- Other names: (Z)-3-Octene; cis-3-Octene; (Z)-3-C8H16; (3Z)-3-Octene; (Z)-Oct-3-ene
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Phase change data
Go To: Top, Reaction thermochemistry data, 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
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 396.1 | K | N/A | Weast and Grasselli, 1989 | BS |
Tboil | 396.04 | K | N/A | Kuus, Kudryavtseva, et al., 1980 | Uncertainty assigned by TRC = 0.2 K; from Int. Data Ser., 1980 (2), 121; TRC |
Tboil | 395.85 | K | N/A | Henne and Greenlee, 1943 | Uncertainty assigned by TRC = 0.5 K; TRC |
Tboil | 394.95 | K | N/A | Mavity, 1931 | Uncertainty assigned by TRC = 0.5 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Tfus | 147. | K | N/A | Campbell and Eby, 1941 | Uncertainty assigned by TRC = 2. K; TRC |
Tfus | 147.15 | K | N/A | Campbell and Eby, 1941, 2 | Uncertainty assigned by TRC = 1.5 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ΔvapH° | 9.49 | kcal/mol | N/A | Reid, 1972 | AC |
Reaction thermochemistry data
Go To: Top, Phase change data, 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 by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.
Individual Reactions
By formula: H2 + C8H16 = C8H18
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -28.15 ± 0.1 | kcal/mol | Chyd | Rogers, Dejroongruang, et al., 1992 | liquid phase; solvent: Cyclohexane |
By formula: C8H18 = H2 + C8H16
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 28.260 | kcal/mol | Eqk | Eliseev, 1986 | liquid phase |
IR Spectrum
Go To: Top, Phase change data, Reaction thermochemistry 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: Coblentz Society, Inc.
Condensed Phase Spectrum
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Notice: Except where noted, spectra from this collection were measured on dispersive instruments, often in carefully selected solvents, and hence may differ in detail from measurements on FTIR instruments or in other chemical environments. More information on the manner in which spectra in this collection were collected can be found here.
Notice: Concentration information is not available for this spectrum and, therefore, molar absorptivity values cannot be derived.
Additional Data
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Owner | Copyright (C) 1987 by the Coblentz Society Collection (C) 2018 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | COLGATE-PALMOLIVE COMPANY (KELLENBACH) |
Source reference | COBLENTZ NO. 9772 |
Date | 1967/01/26 |
Name(s) | (3Z)-3-octene |
State | LIQUID (NEAT) PURITY 96% SOURCE - CHEMICAL SAMPLES CO. |
Instrument | BECKMAN IR-12 (GRATING) |
Instrument parameters | GRATING |
Path length | 0.01056 |
Resolution | 2 |
Sampling procedure | TRANSMISSION |
Data processing | DIGITIZED BY COBLENTZ SOCIETY (BATCH II) FROM HARD COPY |
Mass spectrum (electron ionization)
Go To: Top, Phase change data, Reaction thermochemistry 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-3494 |
NIST MS number | 227617 |
References
Go To: Top, Phase change data, Reaction thermochemistry 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.
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]
Kuus, Kudryavtseva, et al., 1980
Kuus, M.; Kudryavtseva, L.S.; Eisen, O.G.,
Eesti NSV Tead. Akad. Toim., Keem., 1980, 29, 25. [all data]
Henne and Greenlee, 1943
Henne, A.L.; Greenlee, K.W.,
Hydrogenation of the triple bond.,
J. Am. Chem. Soc., 1943, 65, 2020. [all data]
Mavity, 1931
Mavity, J.M.,
, Ph.D. Thesis, Ohio State Univ., Columbus, OH, 1931. [all data]
Campbell and Eby, 1941
Campbell, K.N.; Eby, L.T.,
The preparation of higher cis and trans olefins,
J. Am. Chem. Soc., 1941, 63, 216. [all data]
Campbell and Eby, 1941, 2
Campbell, K.N.; Eby, L.T.,
The Reduction of Multiple Carbon-Carbon Bonds III. Further Studies on the Preparation of Olefins from Acetylenes,
J. Am. Chem. Soc., 1941, 63, 2683. [all data]
Reid, 1972
Reid, Robert C.,
Handbook on vapor pressure and heats of vaporization of hydrocarbons and related compounds, R. C. Wilhort and B. J. Zwolinski, Texas A Research Foundation. College Station, Texas(1971). 329 pages.$10.00,
AIChE J., 1972, 18, 6, 1278-1278, https://doi.org/10.1002/aic.690180637
. [all data]
Rogers, Dejroongruang, et al., 1992
Rogers, D.W.; Dejroongruang, K.; Samuel, S.D.; Fang, W.; Zhao, Y.,
Enthalpies of hydrogenation of the octenes and the methylheptenes,
J. Chem. Thermodyn., 1992, 24, 561-565. [all data]
Eliseev, 1986
Eliseev, N.A.,
Thermodynamic calculation of the equilibrium composition of isomeric octenes in dehydrogenation of n-octane,
Izv. Vyssh. Uchebn. Zaved., Khim. Khim. Tekhnol., 1986, 29, 26-29. [all data]
Notes
Go To: Top, Phase change data, Reaction thermochemistry data, IR Spectrum, Mass spectrum (electron ionization), References
- Symbols used in this document:
Tboil Boiling point Tfus Fusion (melting) point ΔrH° Enthalpy of reaction at standard conditions ΔvapH° Enthalpy of vaporization at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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