Oxirane, (bromomethyl)-
- Formula: C3H5BrO
- Molecular weight: 136.975
- IUPAC Standard InChI: InChI=1S/C3H5BrO/c4-1-3-2-5-3/h3H,1-2H2
- IUPAC Standard InChIKey: GKIPXFAANLTWBM-UHFFFAOYSA-N
- CAS Registry Number: 3132-64-7
- 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-bromo-2,3-epoxy-; (Bromomethyl)ethylene oxide; Epibromhydrin; Epibromohydrin; 1-Bromo-2,3-epoxypropane; 1,2-Epoxy-3-bromopropane; 2-(Bromomethyl)oxirane; (Bromomethyl)oxirane; Epibromohydrine; Propane, 3-bromo-1,2-epoxy-; 3-Bromo-1,2-epoxypropane; UN 2558; (.+/-.)-(Bromomethyl)oxirane; NSC 630; Oxirane, 2-(bromomethyl)-
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Gas phase ion energetics 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:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
Ionization energy determinations
| IE (eV) | Method | Reference | Comment |
|---|---|---|---|
| 10.46 | PE | Baker, Betteridge, et al., 1971 | LLK |
Appearance energy determinations
| Ion | AE (eV) | Other Products | Method | Reference | Comment |
|---|---|---|---|---|---|
| CHO+ | 11.8 ± 0.2 | ? | EI | Wada and Kiser, 1962 | RDSH |
| CH2+ | 21.4 ± 0.5 | ? | EI | Wada and Kiser, 1962 | RDSH |
| CH3+ | 15.6 | ? | EI | Wada and Kiser, 1962 | RDSH |
| CH3O+ | 12.5 ± 0.2 | ? | EI | Wada and Kiser, 1962 | RDSH |
| C2H2+ | 16.7 ± 0.6 | ? | EI | Wada and Kiser, 1962 | RDSH |
| C2H3+ | 14.4 ± 0.2 | ? | EI | Wada and Kiser, 1962 | RDSH |
| C3H5O+ | 10.8 ± 0.1 | Br | EI | Wada and Kiser, 1962 | RDSH |
References
Go To: Top, 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.
Baker, Betteridge, et al., 1971
Baker, A.D.; Betteridge, D.; Kemp, N.R.; Kirby, R.E.,
Application of photoelectron spectrometry to pesticide analysis. II.Photoelectron spectra of hydroxy-, and halo-alkanes and halohydrins,
Anal. Chem., 1971, 43, 375. [all data]
Wada and Kiser, 1962
Wada, Y.; Kiser, R.W.,
Electron impact spectroscopy of some substituted oxiranes,
J. Phys. Chem., 1962, 66, 1652. [all data]
Notes
Go To: Top, Gas phase ion energetics data, References
- Symbols used in this document:
AE Appearance energy - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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