CAS Number: 1679-47-6
3-methyldihydrofuran-2(3H)-one
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Structure |
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| Name: 3-methyldihydrofuran-2(3H)-one |
| Synonyms: |
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| General Information |
Product Number: 1679476
CAS Registry Number:
1679-47-6
Name:
2(3H)-Furanone, dihydro-3-methyl-
Butyric acid, 4-hydroxy-2-methyl-, γ-lactone (6CI,7CI); Butyric acid, γ-hydroxy-α-methyl-, γ-lactone (4CI); (±)-2-Methylbutyrolactone; (±)-Dihydro-3-methyl-2(3H)-furanone; (±)-α-Methyl-γ-butyrolactone; 2-Methyl-4-butanolide; 2-Methyl-γ-butyrolactone; 2-Methylbutanolide; 2-Methylbutyrolactone; 3-Methyl-2-oxooxolane; 3-Methyldihydrofuran-2(3H)-one; 3-Methyldihydrofuran-2-one; 3-Methyltetrahydrofuran-2-one; 4-Hydroxy-2-methylbutanoic acid lactone; 4-Hydroxy-2-methylbutyric acid lactone; Dihydro-3-methyl-2(3H)-furanone; NSC 102837; α-Methyl-γ-butyrolactone; α-Methylbutyrolactone
Deleted CAS Registry Numbers: 69010-09-9
Chemical Formula: C5H8O2
Exact Mass: 100.05
Molecular Weight: 100.12
m/z: 100.05 (100.0%), 101.06 (5.6%)
Elemental Analysis: C, 59.98; H, 8.05; O, 31.96
InChI: InChI=1S/C5H8O2/c1-4-2-3-7-5(4)6/h4H,2-3H2,1H3
InChIKey: QGLBZNZGBLRJGS-UHFFFAOYSA-N
Canonical SMILES : CC1CCOC1=O
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Thermal Properties |
Value |
Condition |
Note |
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Boiling Point |
201-202 °C |
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(1)CAS |
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Boiling Point |
200-201 °C |
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(2)CAS |
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Boiling Point |
200-201 °C |
Press: 745 Torr |
(3)CAS |
|
Boiling Point |
200-201 °C |
Press: 745 Torr |
(4)CAS |
|
Boiling Point |
195-203 °C |
|
(5)CAS |
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Boiling Point |
115 °C |
Press: 6 Torr |
(6)CAS |
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Boiling Point |
103-105 °C |
Press: 40 Torr |
(7)CAS |
|
Boiling Point |
95-97 °C |
Press: 19 Torr |
(8)CAS |
|
Boiling Point |
90 °C |
Press: 20 Torr |
(9)IC |
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Boiling Point |
83-84 °C |
Press: 13 Torr |
(10)CAS |
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Boiling Point |
81 °C |
Press: 11 Torr |
(11)CAS |
|
Boiling Point |
79-82 °C |
Press: 15 Torr |
(12)CAS |
|
Boiling Point |
77 °C |
Press: 9 Torr |
(13)CAS |
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Boiling Point |
76-78 °C |
Press: 12 Torr |
(14)CAS |
|
Boiling Point |
66-69 °C |
Press: 1 Torr |
(15)CAS |
|
Boiling Point |
50-55 °C |
Press: 230 Torr |
(16)CAS |
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Specification |
98%
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| References |
(1) Stepanov, F. N.; Zhurnal Obshchei Khimii 1955, V25, P2480-5 CAPLUS
(2) Falbe, Juergen; US 3318913 1967 CAPLUS
(3) Adams, Roger; Journal of the American Chemical Society 1941, V63, P228-36 CAPLUS
(4) Cavallito, Chester J.; Journal of the American Chemical Society 1946, V68, P2332-4 CAPLUS
(5) Reppe, Walter; Annalen der Chemie, Justus Liebigs 1955, V596, P158-224 CAPLUS
(6) Brun, Kathrin A.; Helvetica Chimica Acta 2005, V88(11), P2951-2959 CAPLUS
(7) Lukes, Rudolf; Chemicke Listy pro Vedu a Prumysl 1957, V51, P2139-42 CAPLUS
(8) Reppe, Walter; Justus Liebigs Annalen der Chemie 1953, V582, P38-71 CAPLUS
(9) Collins, David J.; Australian Journal of Chemistry 1989, V42(1), P223-8 CAPLUS
(10) Mistrik, Edmund J.; CS 124842 1967 CAPLUS
(11) Jones, G.; Tetrahedron 1965, V21(10), P2961-71 CAPLUS
(12) Wilson, Harold F.; US 3238223 1966 CAPLUS
(13) Boekelheide, V.; Journal of the American Chemical Society 1958, V80, P3905-8 CAPLUS
(14) Falbe, Juergen; Brennstoff-Chemie 1967, V48(2), P46-52 CAPLUS
(15) Phillips, Lee Vern; US 3299100 1967 CAPLUS
(16) Semak, Vladislav; Chemical Papers 2008, V62(3), P275-280 CAPLUS
(17) BIORAD: Copyright Bio-Rad Laboratories. All Rights Reserved.
(18) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
(19) Garcia Gutierrez, Jose Luis; Tetrahedron Letters 2005, V46(5), P803-805 CAPLUS
(20) AIST: Integrated Spectral Database System of Organic Compounds. (Data were obtained from the National Institute of Advanced Industrial Science and Technology (Japan))
(21) BIORAD: Infrared spectral data from the Bio-Rad/Sadtler IR Data Collection was obtained from Bio-Rad Laboratories, Philadelphia, PA (US). Copyright © Bio-Rad Laboratories. All Rights Reserved.
(22) Sucrow, Wolfgang; Chemische Berichte 1975, V108(1), P48-53 CAPLUS
(23) Ishii, Yasutaka; Journal of Organic Chemistry 1988, V53(23), P5549-52 CAPLUS
(24) Ishii, Youichi; Journal of Organic Chemistry 1986, V51(11), P2034-9 CAPLUS
(25) Melanova, Klara; Journal of Physics and Chemistry of Solids 2006, V67(5-6), P961-964 CAPLUS
(26) Kollar, Laszlo; Journal of Organometallic Chemistry 1990, V386(3), P389-94 CAPLUS
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