Silane, trimethyl-2-propenyl-
- Formula: C6H14Si
- Molecular weight: 114.2609
- IUPAC Standard InChIKey: HYWCXWRMUZYRPH-UHFFFAOYSA-N
- CAS Registry Number: 762-72-1
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: Silane, allyltrimethyl-; Allyltrimethylsilane; Trimethylallylsilane; 3-(Trimethylsilyl)-1-propene; 3-(Trimethylsilyl)propene; CA0570; Trimethyl-2-propenylsilane
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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: Robert L. Brown and Stephen E. Stein
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 358. to 359. | K | N/A | PCR Inc., 1990 |
Reaction thermochemistry 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: John E. Bartmess
Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.
Individual Reactions
C6H13Si- + =
By formula: C6H13Si- + H+ = C6H14Si
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | <380.56 ± 0.90 | kcal/mol | G+TS | DePuy, Bierbaum, et al., 1980 | gas phase; More acidic than MeOH. Computations indicate dGacid ca. 367 kcal/mol |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | <374.00 | kcal/mol | IMRB | DePuy, Bierbaum, et al., 1980 | gas phase; More acidic than MeOH. Computations indicate dGacid ca. 367 kcal/mol |
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:
B - John E. Bartmess
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
View reactions leading to C6H14Si+ (ion structure unspecified)
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
8.85 ± 0.04 | EI | Bock and Seidl, 1968 | RDSH |
9.0 | PE | Weidner and Schweig, 1972 | Vertical value; LLK |
9.0 | PE | Weidner and Schweig, 1972, 2 | Vertical value; LLK |
De-protonation reactions
C6H13Si- + =
By formula: C6H13Si- + H+ = C6H14Si
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | <380.56 ± 0.90 | kcal/mol | G+TS | DePuy, Bierbaum, et al., 1980 | gas phase; More acidic than MeOH. Computations indicate dGacid ca. 367 kcal/mol; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | <374.00 | kcal/mol | IMRB | DePuy, Bierbaum, et al., 1980 | gas phase; More acidic than MeOH. Computations indicate dGacid ca. 367 kcal/mol; B |
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 | Copyright (C) 1987 by the 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 CORNING CORP. |
Source reference | COBLENTZ NO. 5607 |
Date | 1965/02/19 |
Name(s) | allyl(trimethyl)silane |
State | SOLUTION (5% CCl4 FOR 3800-1300, 2% CS2 FOR 1300-650, AND 5% CCl4 FOR 650-250) |
Instrument | PERKIN-ELMER 521 (GRATING) |
Instrument parameters | FILTERS AT 3150, 2500, 2000, 1150, 700, 410. GRATING CHANGES: 2000, 630 |
Path length | 0.011 CM, 0.011 CM, AND 0.020 CM |
Resolution | 2 |
Mass spectrum (electron ionization)
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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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
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Additional Data
View image of digitized spectrum (can be printed in landscape orientation).
Due to licensing restrictions, this spectrum cannot be downloaded.
Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | D.HENNEBERG, MAX-PLANCK INSTITUTE, MULHEIM, WEST GERMANY |
NIST MS number | 63588 |
References
Go To: Top, Phase change data, Reaction thermochemistry data, Gas phase ion energetics data, IR Spectrum, Mass spectrum (electron ionization), Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
PCR Inc., 1990
PCR Inc.,
Research Chemicals Catalog 1990-1991, PCR Inc., Gainesville, FL, 1990, 1. [all data]
DePuy, Bierbaum, et al., 1980
DePuy, C.H.; Bierbaum, V.M.; Flippin, L.A.; Brabowski, J.J.; King, G.K.; Schmidt, R.J.; Sullivan, S.A.,
Gas phase reactions of anions with substituted silanes,
J. Am. Chem. Soc., 1980, 102, 5012. [all data]
Bock and Seidl, 1968
Bock, H.; Seidl, H.,
d-Orbitaleffekte in siliziumsubstituierten π-Elektronensystemen. VI. Spektroskopische Untersuchungen an Alkyl- und Silylathylenen,
J. Organometal. Chem., 1968, 13, 87. [all data]
Weidner and Schweig, 1972
Weidner, U.; Schweig, A.,
Theory and application of photoelectron spectroscopy. V. The nature of bonding in vinyl- and allylsilanes: the effects of σ-π (hyperconjugation) pπ-dπ conjugation in these compounds,
J. Organomet. Chem., 1972, 39, 261. [all data]
Weidner and Schweig, 1972, 2
Weidner, U.; Schweig, A.,
Nature of the silicon β-effect in allyltrimethylsilane,
Angew. Chem. Int. Ed. Engl., 1972, 11, 146. [all data]
Notes
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- Symbols used in this document:
Tboil Boiling point ΔrG° Free energy of reaction at standard conditions ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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