Cas no 88456-27-3 (2-Propenenitrile, 3-ethoxy-2-methyl-, (E)-)
88456-27-3 structure
Product Name:2-Propenenitrile, 3-ethoxy-2-methyl-, (E)-
CAS No:88456-27-3
MF:C6H9NO
MW:111.141761541367
CID:632222
PubChem ID:20549566
Update Time:2025-04-19
2-Propenenitrile, 3-ethoxy-2-methyl-, (E)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenenitrile, 3-ethoxy-2-methyl-, (E)-
- 63144-85-4
- 88456-27-3
- 3-Ethoxy-2-methylacrylonitrile
- (E)-3-Ethoxy-2-methylacrylonitrile
-
- Inchi： 1S/C6H9NO/c1-3-8-5-6(2)4-7/h5H,3H2,1-2H3/b6-5+
- InChI Key： JFBHVVYTNQTFOR-AATRIKPKSA-N
- SMILES： O(/C=C(/C#N)\C)CC
Computed Properties
- Exact Mass: 111.068413911g/mol
- Monoisotopic Mass: 111.068413911g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 2
- Complexity: 129
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.9
- Topological Polar Surface Area: 33?2
2-Propenenitrile, 3-ethoxy-2-methyl-, (E)- Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
88456-27-3 (2-Propenenitrile, 3-ethoxy-2-methyl-, (E)-) Related Products
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