3-Chloropropionic acid, heptyl ester
- Formula: C10H19ClO2
- Molecular weight: 206.710
- IUPAC Standard InChI: InChI=1S/C10H19ClO2/c1-2-3-4-5-6-9-13-10(12)7-8-11/h2-9H2,1H3
- IUPAC Standard InChIKey: BQZQUWKYBJWQNL-UHFFFAOYSA-N
- CAS Registry Number: 74306-04-0
- 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: Propanoic acid, 3-chloro, heptyl ester; Heptyl 3-chloropropanoate
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Kovats' RI, non-polar column, isothermal
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 | SE-30 | SE-30 | SE-30 | SE-30 | SE-30 |
| Column length (m) | 25. | 25. | 25. | 25. | 25. |
| Carrier gas | |||||
| Substrate | |||||
| Column diameter (mm) | 0.33 | 0.33 | 0.33 | 0.33 | 0.33 |
| Phase thickness (μm) | |||||
| Temperature (C) | 100. | 120. | 140. | 160. | 180. |
| I | 1387. | 1386. | 1391. | 1393. | 1394. |
| Reference | Haken and Korhonen, 1985 | Haken and Korhonen, 1985 | Haken and Korhonen, 1985 | Haken and Korhonen, 1985 | Haken and Korhonen, 1985 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|
| Active phase | SE-30 | SE-30 | SE-30 | OV-101 |
| Column length (m) | 25. | 25. | 25. | 15. |
| Carrier gas | ||||
| Substrate | ||||
| Column diameter (mm) | 0.33 | 0.33 | 0.33 | 0.22 |
| Phase thickness (μm) | ||||
| Temperature (C) | 200. | 220. | 240. | 200. |
| I | 1399. | 1385. | 1402. | 1405. |
| Reference | Haken and Korhonen, 1985 | Haken and Korhonen, 1985 | Haken and Korhonen, 1985 | Komárek, Hornová, et al., 1983 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Kovats' RI, non-polar column, isothermal, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Haken and Korhonen, 1985
Haken, J.K.; Korhonen, I.O.O.,
Gas chromatography of homologous esters. XXVII. Retention increments of C1-C18 primary alkanols and their 2-chloropropanoyl and 3-chloropropanoyl derivatives on SE-30 and OV-351 capillary columns,
J. Chromatogr., 1985, 319, 131-142, https://doi.org/10.1016/S0021-9673(01)90548-5
. [all data]
Komárek, Hornová, et al., 1983
Komárek, K.; Hornová, L.; Horna, A.; Churácek, J.,
Glass capillary gas chromatography of homologous series of esters. III. Separation of alkyl halogenopropionates and halogenobutyrates on OV-101,
J. Chromatogr., 1983, 262, 316-320, https://doi.org/10.1016/S0021-9673(01)88112-7
. [all data]
Notes
Go To: Top, Kovats' RI, non-polar column, isothermal, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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