Bis(2-chloroethyl) ether
- Formula: C4H8Cl2O
- Molecular weight: 143.012
- IUPAC Standard InChI: InChI=1S/C4H8Cl2O/c5-1-3-7-4-2-6/h1-4H2
- IUPAC Standard InChIKey: ZNSMNVMLTJELDZ-UHFFFAOYSA-N
- CAS Registry Number: 111-44-4
- 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: s-Dichloroethyl ether; Ethane, 1,1'-oxybis[2-chloro-; Ether, bis(2-chloroethyl); β,β'-Dichlorodiethyl ether; β,β'-Dichloroethyl ether; Bis(β-chloroethyl) ether; Bis(chloro-2-ethyl) oxide; Chlorex; Di(β-chloroethyl) ether; DCEE; Khloreks; 1-Chloro-2-(β-Chloroethoxy)ethane; 2-Chloroethyl ether; 2,2'-Dichlorethyl ether; 2,2'-Dichlorodiethyl ether; 2,2'-Dichloroethyl ether; 2,2'-Dichlorodiethyl oxide; sym-Dichloroethyl ether; Chloroethyl ether; Clorex; Di(2-chloroethyl) ether; Dichloroether; Dichloroethyl ether; Dichloroethyl oxide; Dwuchlorodwuetylowy eter; Ether dichlore; ENT 4,504; Oxyde de chlorethyle; 1,1'-Oxybis(2-chloroethane); 1,5-Dichloro-3-oxapentane; 2,2'-Dichloorethylether; 2,2'-Dichlor-diaethylaether; 2,2'-Dicloroetiletere; Rcra waste number U025; UN 1916; Diethylene glycol dichloride; Ether, bis(chloroethyl); Beta,beta'-dichloroethyl ether; BCEE; NSC 406647
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Van Den Dool and Kratz RI, non-polar column, temperature ramp
Go To: Top, 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
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-1 | OV-1 | SE-54 | Ultra-1 | DB-1 |
| Column length (m) | 30. | 15. | 25. | 25. | 15. |
| Carrier gas | He | He | He | He | |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.32 | 0.32 | 0.32 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.52 | 0.25 |
| Tstart (C) | 40. | 50. | 40. | 35. | 50. |
| Tend (C) | 325. | 280. | 280. | 320. | 300. |
| Heat rate (K/min) | 3. | 10. | 10. | 15. | 10. |
| Initial hold (min) | 2. | 1. | 2. | ||
| Final hold (min) | 10. | 10. | 10. | 5. | |
| I | 945.9 | 948. | 984. | 951.52 | 948. |
| Reference | Sun and Stremple, 2003 | Kostiainen, 2000 | Kostiainen, 2000 | Richmond and Pombo-Villar, 1997 | D'agostino and Provost, 1988 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary |
|---|---|
| Active phase | DB-5 |
| Column length (m) | 15. |
| Carrier gas | |
| Substrate | |
| Column diameter (mm) | 0.32 |
| Phase thickness (μm) | 0.25 |
| Tstart (C) | 50. |
| Tend (C) | 300. |
| Heat rate (K/min) | 10. |
| Initial hold (min) | 2. |
| Final hold (min) | 5. |
| I | 984. |
| Reference | D'agostino and Provost, 1988 |
| Comment | MSDC-RI |
References
Go To: Top, Van Den Dool and Kratz RI, non-polar column, temperature ramp, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Sun and Stremple, 2003
Sun, G.; Stremple, P.,
Retention index characterization of flavor, fragrance, and many other compounds on DB-1 and DB-XLB, 2003, retrieved from http://www.chem.agilent.com/cag/cabu/pdf/b-0279.pdf. [all data]
Kostiainen, 2000
Kostiainen, O.,
Gas Chromatography in Screening of Chemicals Related to the Chemical Weapons Convention
in Encyclopedia of Analytical Chemistry, Meyers, R.A., ed(s)., John Wiley Sons Ltd, Chichester, 2000, 963-979. [all data]
Richmond and Pombo-Villar, 1997
Richmond, R.; Pombo-Villar, E.,
Short communication. Gas chromatography-mass spectrometry coupled with pseudo-Sadtler retention indices, for the identification of components in the essential oil of Curcuma longa L.,
J. Chromatogr. A, 1997, 760, 2, 303-308, https://doi.org/10.1016/S0021-9673(96)00802-3
. [all data]
D'agostino and Provost, 1988
D'agostino, P.A.; Provost, L.R.,
Gas chromatographic retention indices of sulphur vesicants and related compounds,
J. Chromatogr., 1988, 436, 399-411, https://doi.org/10.1016/S0021-9673(00)94599-0
. [all data]
Notes
Go To: Top, Van Den Dool and Kratz RI, non-polar column, temperature ramp, References
- Symbols used in this document:
Tend Final temperature Tstart Initial temperature - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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