Propanenitrile, 3-(dimethylamino)-
- Formula: C5H10N2
- Molecular weight: 98.1463
- IUPAC Standard InChIKey: MTPJEFOSTIKRSS-UHFFFAOYSA-N
- CAS Registry Number: 1738-25-6
- 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: Propionitrile, 3-(dimethylamino)-; β-(Dimethylamino)propionitrile; β-(N-Dimethylamino)propionitrile; N,N-(Dimethylamino)-3-propionitrile; 3-(Dimethylamino)propionitrile; 3-(N,N-Dimethylamino)propionitrile; Dimethylaminopropionitrile; 3-(Dimethylamino)propanenitrile; 3-Dimethylaminopropanonitrile; beta-Dimethylaminopropionitrile; DMAPN; NSC 232; 3-dimethylaminopropiononitrile
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Gas phase 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 as indicated in comments:
DRB - Donald R. Burgess, Jr.
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°gas | 96.7 | kJ/mol | N/A | Gutner, Lebedeva, et al., 1979 | Value computed using ΔfHliquid° value of 43.6±0.5 kj/mol from Gutner, Lebedeva, et al., 1979 and ΔvapH° value of 53.05 kj/mol from missing citation.; DRB |
ΔfH°gas | 90.4 | kJ/mol | Ccb | Vasil'eva and Kotov, 1977 | hf298 calculated possible error by author; ALS |
Condensed phase 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 as indicated in comments:
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°liquid | 43.6 ± 0.5 | kJ/mol | Ccb | Gutner, Lebedeva, et al., 1979 | Authors hf298_condensed=-43.6±0.5 kJ/mol; ALS |
Quantity | Value | Units | Method | Reference | Comment |
ΔcH°liquid | -3440.3 ± 0.5 | kJ/mol | Ccb | Gutner, Lebedeva, et al., 1979 | Authors hf298_condensed=-43.6±0.5 kJ/mol; ALS |
ΔcH°liquid | -3434. ± 3. | kJ/mol | Ccb | Vasil'eva and Kotov, 1977 | hf298 calculated possible error by author; ALS |
Quantity | Value | Units | Method | Reference | Comment |
S°liquid | 266.4 | J/mol*K | N/A | Dzhafarov, Karasharli, et al., 1982 | DH |
Constant pressure heat capacity of liquid
Cp,liquid (J/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
212.5 | 298.15 | Dzhafarov, Karasharli, et al., 1982 | T = 12 to 300 K.; DH |
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 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 | 446.2 | K | N/A | Weast and Grasselli, 1989 | BS |
Quantity | Value | Units | Method | Reference | Comment |
Tfus | 228.5 | K | N/A | Anonymous, 1954 | Uncertainty assigned by TRC = 0.6 K; TRC |
Tfus | 228.35 | K | N/A | Witschonke, 1954 | Uncertainty assigned by TRC = 0.35 K; TRC |
Tfus | 228.85 | K | N/A | Witschonke, 1954 | Uncertainty assigned by TRC = 0.2 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ΔvapH° | 53.05 | kJ/mol | V | Vasil'eva and Kotov, 1977 | hf298 calculated possible error by author; ALS |
Reduced pressure boiling point
Tboil (K) | Pressure (bar) | Reference | Comment |
---|---|---|---|
444.2 | 1.00 | Aldrich Chemical Company Inc., 1990 | BS |
Enthalpy of vaporization
ΔvapH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
45.9 | 345. | A | Stephenson and Malanowski, 1987 | Based on data from 330. to 445. K.; AC |
52.4 | 346. | A | Stephenson and Malanowski, 1987 | Based on data from 331. to 407. K.; AC |
44.1 ± 0.2 | 290. to 317. | N/A | Lebedeva, Gutner, et al., 1984 | AC |
References
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Gutner, Lebedeva, et al., 1979
Gutner, N.M.; Lebedeva, N.D.; Kiseleva, N.N.,
Enthalpies of combustion and formation of some acyl-substituted diamines,
Termodin. Org. Soedin., 1979, 97-98. [all data]
Vasil'eva and Kotov, 1977
Vasil'eva, T.F.; Kotov, V.I.,
Heats of combustion of dimethyl-substituted amides and dimethylalkylamines,
Vses. Konf. Kalorim. Rasshir. Tezisy Dokl. 7th, 1977, 1, 102-106. [all data]
Dzhafarov, Karasharli, et al., 1982
Dzhafarov, O.I.; Karasharli, K.A.; Kuliev, A.M.,
Study of the real heat capacity of β-dimethylaminopropionitrile in the range 12-300K,
Azerb. Khim. Zhur., 1982, No.2, 92-95. [all data]
Weast and Grasselli, 1989
CRC Handbook of Data on Organic Compounds, 2nd Editon, Weast,R.C and Grasselli, J.G., ed(s)., CRC Press, Inc., Boca Raton, FL, 1989, 1. [all data]
Anonymous, 1954
Anonymous, R.,
, Am. Pet. Inst. Res. Proj. 45, Tech. Rep. 13, Ohio State Univ., 1954. [all data]
Witschonke, 1954
Witschonke, C.R.,
Freezing point and purity data for some organic compounds,
Anal. Chem., 1954, 26, 562-4. [all data]
Aldrich Chemical Company Inc., 1990
Aldrich Chemical Company Inc.,
Catalog Handbook of Fine Chemicals, Aldrich Chemical Company, Inc., Milwaukee WI, 1990, 1. [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]
Lebedeva, Gutner, et al., 1984
Lebedeva, N.V.; Gutner, N.M.; Katin, Yu.A.; Kozlova, N.M.; Kiseleva, N.N.; Makhina, E.F.; Dobychin, S.L.,
Russ. J. Phys. Chem., 1984, 57, 2118. [all data]
Notes
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, References
- Symbols used in this document:
Cp,liquid Constant pressure heat capacity of liquid S°liquid Entropy of liquid at standard conditions Tboil Boiling point Tfus Fusion (melting) point ΔcH°liquid Enthalpy of combustion of liquid at standard conditions ΔfH°gas Enthalpy of formation of gas at standard conditions ΔfH°liquid Enthalpy of formation of liquid at standard conditions ΔvapH Enthalpy of vaporization ΔvapH° Enthalpy of vaporization at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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