Phenol, 2,4-dichloro-, acetate
- Formula: C8H6Cl2O2
- Molecular weight: 205.038
- IUPAC Standard InChI: InChI=1S/C8H6Cl2O2/c1-5(11)12-8-3-2-6(9)4-7(8)10/h2-4H,1H3
- IUPAC Standard InChIKey: KGXUYVOKSRCTEK-UHFFFAOYSA-N
- CAS Registry Number: 6341-97-5
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: 2,4-Dichlorophenol acetate; 2,4-Dichlorophenyl acetate; Acetic acid, 2,4-dichlorophenyl ester
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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 by: Robert L. Brown and Stephen E. Stein
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| Tboil | 517.7 | K | N/A | Weast and Grasselli, 1989 |
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 compiled by: Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
Ionization energy determinations
| IE (eV) | Method | Reference |
|---|---|---|
| 8.16 ± 0.03 | EI | Benezra and Bursey, 1972 |
Appearance energy determinations
| Ion | AE (eV) | Other Products | Method | Reference | Comment |
|---|---|---|---|---|---|
| C2H3O+ | 12.11 ± 0.03 | ? | EI | Benezra and Bursey, 1972 | |
| C6H4OCl2+ | 9.37 ± 0.03 | CH2=C=O | EI | Benezra and Bursey, 1972 |
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.
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]
Benezra and Bursey, 1972
Benezra, S.A.; Bursey, M.M.,
ortho-Effects in mass spectra. Alteration of the molecular-ion energy distribution in disubstituted acetanilides,
Z. Naturforsch. A:, 1972, 27, 670. [all data]
Notes
Go To: Top, Phase change data, Gas phase ion energetics data, References
- Symbols used in this document:
AE Appearance energy Tboil Boiling point - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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