2-Butoxyethyl acetate
- Formula: C8H16O3
- Molecular weight: 160.2108
- IUPAC Standard InChI: InChI=1S/C8H16O3/c1-3-4-5-10-6-7-11-8(2)9/h3-7H2,1-2H3
- IUPAC Standard InChIKey: NQBXSWAWVZHKBZ-UHFFFAOYSA-N
- CAS Registry Number: 112-07-2
- 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: Butyl cellosolve acetate; 1-Acetoxy-2-butoxyethane; Ethylene glycol monobutyl ether acetate; Ethylene glycol mono-n-butyl ether acetate; Ethanol, 2-butoxy-, acetate; Butylglycol acetate; Acetic acid, 2-butoxyethyl ester; 2-Butoxyethanol acetate; 2-Butoxyethylester kyseliny octove; Butylcelosolvacetat; Ektasolve eb acetate; Glycol monobutyl ether acetate; Butoxyethyl acetate; Ethylene glycol butyl ether acetate; Butoxyethanol acetate; n-Butyl cellosolve acetate; Ethanol, 2-butoxy-, 1-acetate
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Phase change data
Go To: Top, Gas Chromatography, 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:
BS - Robert L. Brown and Stephen E. Stein
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
AC - William E. Acree, Jr., James S. Chickos
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| Tboil | 465.2 | K | N/A | Aldrich Chemical Company Inc., 1990 | BS |
| Tboil | 466.2 | K | N/A | Kusano, 1978 | Uncertainty assigned by TRC = 1.5 K; accompanied by decomposition; TRC |
| Quantity | Value | Units | Method | Reference | Comment |
| Tfus | 209.7 | K | N/A | Anonymous, 1957 | Uncertainty assigned by TRC = 0.6 K; TRC |
| Quantity | Value | Units | Method | Reference | Comment |
| Tc | 641.2 | K | N/A | Teja and Anselme, 1990 | Uncertainty assigned by TRC = 1.6 K; TRC |
| Tc | 640.2 | K | N/A | Teja and Rosenthal, 1990 | Uncertainty assigned by TRC = 0.8 K; TRC |
| Quantity | Value | Units | Method | Reference | Comment |
| Pc | 26.94 | bar | N/A | Teja and Rosenthal, 1990 | Uncertainty assigned by TRC = 0.40 bar; TRC |
| Quantity | Value | Units | Method | Reference | Comment |
| ρc | 1.82 | mol/l | N/A | Teja and Anselme, 1990 | Uncertainty assigned by TRC = 0.04 mol/l; TRC |
| Quantity | Value | Units | Method | Reference | Comment |
| ΔvapH° | 59.54 ± 0.04 | kJ/mol | C | Kusano and Wads, 1970 | ALS |
| ΔvapH° | 59.5 ± 0.1 | kJ/mol | C | Kusano and Wadso, 1970 | AC |
Enthalpy of vaporization
| ΔvapH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
|---|---|---|---|---|
| 51.9 | 308. | A | Stephenson and Malanowski, 1987 | Based on data from 293. to 465. K.; AC |
Gas Chromatography
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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Van Den Dool and Kratz RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | SPB-5 | 1096. | Pino, Marbot, et al., 2004 | 30. m/0.25 mm/0.25 μm, He, 60. C @ 2. min, 4. K/min, 250. C @ 20. min |
| Capillary | DB-5 | 1120.2 | Komárek, Richter, et al., 1998 | He, 5.5 K/min; Column length: 20. m; Column diameter: 0.25 mm; Tstart: 50. C; Tend: 350. C |
| Capillary | DB-5 | 1090. | Olson, Wong, et al., 1987 | 30. m/0.32 mm/1.0 μm, 5. K/min; Tstart: 20. C; Tend: 200. C |
Van Den Dool and Kratz RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | VF-5MS | 1090. | Zheng and White, 2008 | 30. m/0.25 mm/0.25 μm, He; Program: not specified |
Normal alkane RI, non-polar column, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Packed | DC-400 | 150. | 1053. | Anderson, 1968 | Helium, Gas-Pak (60-80 mesh); Column length: 3.0 m |
Normal alkane RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | BP-1 | 1061. | Health Safety Executive, 2000 | 50. m/0.22 mm/0.75 μm, He, 5. K/min; Tstart: 50. C; Tend: 200. C |
| Capillary | DB-5 | 1089.8 | Olson, Wong, et al., 1988 | 30. m/0.32 mm/1. μm, 5. K/min; Tstart: 20. C; Tend: 200. C |
Normal alkane RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-5 MS | 1087. | Cajka, Hajslova, et al., 2007 | 30. m/0.25 mm/0.25 μm, Helium; Program: 45 0C (0.75 min) 10 0C/min -> 200 0C 30 0C/min -> 245 0C (1.25 min) |
References
Go To: Top, Phase change data, Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Aldrich Chemical Company Inc., 1990
Aldrich Chemical Company Inc.,
Catalog Handbook of Fine Chemicals, Aldrich Chemical Company, Inc., Milwaukee WI, 1990, 1. [all data]
Kusano, 1978
Kusano, K.,
Densities, Refractive Indexes, and Normal Boiling Points of 1,2-Disubstituted Ethylene Glycol Derivatives,
J. Chem. Eng. Data, 1978, 23, 141. [all data]
Anonymous, 1957
Anonymous, R.,
, Am. Pet. Inst. Res. Proj. 6, Carnegie-Mellon Univ., 1957. [all data]
Teja and Anselme, 1990
Teja, A.S.; Anselme, M.J.,
The critical properties of thermally stable and unstable fluids. II. 1986 results,
AIChE Symp. Ser., 1990, 86, 279, 122-7. [all data]
Teja and Rosenthal, 1990
Teja, A.S.; Rosenthal, D.J.,
The Critical Pressures and Temperatures of Twelve Substances Using A Low Residence Time Flow Apparatus,
AIChE Symp. Ser., 1990, 86, 279, 133-7. [all data]
Kusano and Wads, 1970
Kusano, K.; Wads, I.,
Enthalpies of vaporization of organic compounds,
Acta Chem. Scand., 1970, 24, 2037. [all data]
Kusano and Wadso, 1970
Kusano, K.; Wadso, I.,
Enthalpies of vaporization of organic compounds,
Acta Chem. Scand., 1970, 24, 2037-2042. [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]
Pino, Marbot, et al., 2004
Pino, J.A.; Marbot, R.; Vazquez, C.,
Volatile components of tamarind (Tamarindus indica L.) grown in Cuba,
J. Essent. Oil Res., 2004, 16, 4, 318-320, https://doi.org/10.1080/10412905.2004.9698731
. [all data]
Komárek, Richter, et al., 1998
Komárek, K.; Richter, P.; Hoffmann, J.,
Capillary gas chromatography of n-butyl and isobutyl-, n-amyl and isoamyl polyethylene glycol ethers and their derivatives,
J. Chromatogr. A, 1998, 800, 2, 305-315, https://doi.org/10.1016/S0021-9673(97)01144-8
. [all data]
Olson, Wong, et al., 1987
Olson, K.L.; Wong, C.A.; Fleck, L.L.; Lazar, D.F.,
Qualitative and Quantitative Determination of Solvent Formulations in Automotive Paints,
J. Chromatogr. Sci., 1987, 25, 9, 418-423, https://doi.org/10.1093/chromsci/25.9.418
. [all data]
Zheng and White, 2008
Zheng, Y.; White, E.,
Retention Data. NIST Mass Spectrometry Data Center., NIST Mass Spectrometry Data Center, 2008. [all data]
Anderson, 1968
Anderson, D.G.,
USe of Kovats retention indices and response factors for the qualitative and quantitative analysis of coating solvents,
J. Paint Technol., 1968, 40, 527, 549-557. [all data]
Health Safety Executive, 2000
Health Safety Executive,
MDHS 96 Volatile organic compounds in air - Laboratory method using pumed solid sorbent tubes, solvent desorption and gas chromatography
in Methods for the Determination of Hazardous Substances (MDHS) guidance, Crown, Colegate, Norwich, 2000, 1-24, retrieved from http://www.hse.gov.uk/pubns/mdhs/pdfs/mdhs96.pdf. [all data]
Olson, Wong, et al., 1988
Olson, K.L.; Wong, C.A.; Fleck, L.L.; Lazar, D.F.,
Qualitative and quantitative determination of solvent formulations in automotive paints,
J. Coat. Technol., 1988, 60, 762, 45-50. [all data]
Cajka, Hajslova, et al., 2007
Cajka, T.; Hajslova, J.; Cochran, J.; Holadova, K.; Klimankova, E.,
Solid phase microextraction - comprehensive two dimensional gas chromatography - time-of-flight mass spectrometry for the analysis of honey volatiles,
J. Sep. Sci., 2007, 30, 4, 534-546, https://doi.org/10.1002/jssc.200600413
. [all data]
Notes
Go To: Top, Phase change data, Gas Chromatography, References
- Symbols used in this document:
Pc Critical pressure Tboil Boiling point Tc Critical temperature Tfus Fusion (melting) point ΔvapH Enthalpy of vaporization ΔvapH° Enthalpy of vaporization at standard conditions ρc Critical density - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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