Alpha-phenylethyl n-butyl ether
- Formula: C12H18O
- Molecular weight: 178.2707
- IUPAC Standard InChI: InChI=1S/C12H18O/c1-3-4-10-13-11(2)12-8-6-5-7-9-12/h5-9,11H,3-4,10H2,1-2H3
- IUPAC Standard InChIKey: AQGPVCBVZAHVBN-UHFFFAOYSA-N
- CAS Registry Number: 4157-77-1
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
View 3d structure (requires JavaScript / HTML 5) - Other names: (1-Butoxyethyl)benzene
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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: William E. Acree, Jr., James S. Chickos
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔvapH° | 14.3 ± 0.07 | kcal/mol | GS | Verevkin and Heintz, 2001 | Based on data from 278. to 318. K. |
IR Spectrum
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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: Coblentz Society, Inc.
Condensed Phase Spectrum
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Notice: Except where noted, spectra from this collection were measured on dispersive instruments, often in carefully selected solvents, and hence may differ in detail from measurements on FTIR instruments or in other chemical environments. More information on the manner in which spectra in this collection were collected can be found here.
Notice: Concentration information is not available for this spectrum and, therefore, molar absorptivity values cannot be derived.
Additional Data
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| Owner | COBLENTZ SOCIETY Collection (C) 2018 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
|---|---|
| Origin | DOW CHEMICAL COMPANY |
| Source reference | COBLENTZ NO. 3161 |
| Date | Not specified, most likely prior to 1970 |
| Name(s) | butyl 1-phenylethyl ether (1-butoxyethyl)benzene |
| State | SOLUTION (10% CCl4 FOR 5000-1330, 10% CS2 FOR 1330-625 CM-1) |
| Instrument | Not specified, most likely a prism, grating, or hybrid spectrometer. |
| Path length | 0.0124 CM, 0.0124 CM SPECTRAL CONTAMINATION DUE TO CCl4 AROUND 1550 CM-1 |
| Resolution | 4 |
| Sampling procedure | TRANSMISSION |
| Data processing | DIGITIZED BY NIST FROM HARD COPY |
References
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Verevkin and Heintz, 2001
Verevkin, Sergey P.; Heintz, Andreas,
Chemical Equilibrium Study in the Reacting System of the (1-Alkoxyethyl)benzene Synthesis from Alkanols and Styrene,
J. Chem. Eng. Data, 2001, 46, 4, 984-990, https://doi.org/10.1021/je000378c
. [all data]
Notes
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- Symbols used in this document:
ΔvapH° Enthalpy of vaporization at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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