Cas no 98425-68-4 (Butanenitrile,2-acetyl-2-ethyl-)
98425-68-4 structure
Product Name:Butanenitrile,2-acetyl-2-ethyl-
CAS No:98425-68-4
MF:C8H13NO
MW:139.194922208786
CID:801768
PubChem ID:84819970
Update Time:2025-07-12
Butanenitrile,2-acetyl-2-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- Butanenitrile,2-acetyl-2-ethyl-
- 2,2-diethyl-acetoacetonitrile
- Acetoacetonitrile, 2,2-diethyl- (6CI)
- 2,2-Diethyl-3-oxobutanenitrile
- SCHEMBL6874918
- 98425-68-4
- DB-284645
- Acetoacetonitrile, 2,2-diethyl-
-
- Inchi： 1S/C8H13NO/c1-4-8(5-2,6-9)7(3)10/h4-5H2,1-3H3
- InChI Key： VSQMNHSNKKLBKJ-UHFFFAOYSA-N
- SMILES： O=C(C)C(C#N)(CC)CC
Computed Properties
- Exact Mass: 139.1
- Monoisotopic Mass: 139.1
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 171
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 40.9A^2
- XLogP3: 1.5
Butanenitrile,2-acetyl-2-ethyl- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1750912-1g |
2,2-Diethyl-3-oxobutanenitrile |
98425-68-4 | 98% | 1g |
￥5268.00 | 2024-04-23 |
Butanenitrile,2-acetyl-2-ethyl- Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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