(Z)-1-Phenylpropene
- Formula: C9H10
- Molecular weight: 118.1757
- IUPAC Standard InChIKey: QROGIFZRVHSFLM-KXFIGUGUSA-N
- CAS Registry Number: 766-90-5
- 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: cis-β-Methylstyrene; cis-Propenylbenzene; cis-1-Phenyl-1-propene; cis-1-Phenylpropene; cis-1-Propenylbenzene; Benzene, propenyl-, (Z)-; Benzene, 1-propenyl-, (Z)-; 1-Phenyl-1-propene, cis-; Benzene, propen-1-yl-, (Z)-; Benzene, (1Z)-1-propenyl-; (Z)-1-Propenylbenzene
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Phase change data
Go To: Top, Gas phase ion energetics 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 as indicated in comments:
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 | 440.58 | K | N/A | Anonymous, 1953 | Uncertainty assigned by TRC = 0.3 K; TRC |
Tboil | 441.65 | K | N/A | Mixer, Heck, et al., 1953 | Uncertainty assigned by TRC = 3. K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Tfus | 203.4 | K | N/A | Park and Wright, 1954 | Uncertainty assigned by TRC = 1. K; TRC |
Tfus | 211.23 | K | N/A | Anonymous, 1953 | Uncertainty assigned by TRC = 0.2 K; TRC |
Tfus | 211.47 | K | N/A | Anonymous, 1953 | Uncertainty assigned by TRC = 0.15 K; TRC |
Enthalpy of vaporization
ΔvapH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
44.8 | 363. | A | Stephenson and Malanowski, 1987 | Based on data from 348. to 498. K.; AC |
Gas phase ion energetics data
Go To: Top, 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 evaluated as indicated in comments:
HL - Edward P. Hunter and Sharon G. Lias
Data compiled as indicated in comments:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
View reactions leading to C9H10+ (ion structure unspecified)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Proton affinity (review) | 836.4 | kJ/mol | N/A | Hunter and Lias, 1998 | HL |
Quantity | Value | Units | Method | Reference | Comment |
Gas basicity | 807.5 | kJ/mol | N/A | Hunter and Lias, 1998 | HL |
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
8.15 | PE | Kobayashi, Arai, et al., 1981 | LLK |
8.15 | PE | Fu and Dunbar, 1978 | LLK |
8.45 | PE | Salisbury, 1974 | LLK |
8.48 | PE | Kobayashi, Arai, et al., 1981 | Vertical value; LLK |
8.28 | PE | Fu and Dunbar, 1978 | Vertical value; LLK |
References
Go To: Top, Phase change data, Gas phase ion energetics data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Anonymous, 1953
Anonymous, R.,
, Physical Properties of Chemical Substances, Dow Chemical Company, 1953. [all data]
Mixer, Heck, et al., 1953
Mixer, R.Y.; Heck, R.F.; Winstein, S.; Young, W.G.,
cis- and trans-Propenylbenzene and Their Azeotropes with n-Decane,
J. Am. Chem. Soc., 1953, 75, 4094. [all data]
Park and Wright, 1954
Park, W.R.R.; Wright, G.F.,
J. Org. Chem., 1954, 19, 1435. [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]
Hunter and Lias, 1998
Hunter, E.P.; Lias, S.G.,
Evaluated Gas Phase Basicities and Proton Affinities of Molecules: An Update,
J. Phys. Chem. Ref. Data, 1998, 27, 3, 413-656, https://doi.org/10.1063/1.556018
. [all data]
Kobayashi, Arai, et al., 1981
Kobayashi, T.; Arai, T.; Sakuragi, H.; Tokumaru, K.; Utsunomiya, C.,
A new nethod for conformational analysis by photoelectron spectroscopy with application to alkyl-substituted styrenes,
Bull. Chem. Soc. Jpn., 1981, 54, 1658. [all data]
Fu and Dunbar, 1978
Fu, E.W.; Dunbar, R.C.,
Photodissociation spectroscopy and structural rearrangements in ions of cyclooctatetraene, styrene and related molecules,
J. Am. Chem. Soc., 1978, 100, 2283. [all data]
Salisbury, 1974
Salisbury, K.,
Quenching of the fluorescence of styrenes by ground state oxygen,
J. Photochem., 1974, 2, 401. [all data]
Notes
Go To: Top, Phase change data, Gas phase ion energetics data, References
- Symbols used in this document:
Tboil Boiling point Tfus Fusion (melting) point ΔvapH Enthalpy of vaporization - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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