Cas no 72111-81-0 (5-ethoxypyrazine-2,3-dicarbonitrile)
72111-81-0 structure
Product Name:5-ethoxypyrazine-2,3-dicarbonitrile
CAS No:72111-81-0
MF:C8H6N4O
MW:174.159440517426
CID:2359322
PubChem ID:13336841
Update Time:2024-03-01
5-ethoxypyrazine-2,3-dicarbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 5-ethoxypyrazine-2,3-dicarbonitrile
- 5-ethoxy-pyrazine-2,3-dicarbonitrile
- CID 13336841
- 2,3-Pyrazinedicarbonitrile, 5-ethoxy-
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- Inchi： 1S/C8H6N4O/c1-2-13-8-5-11-6(3-9)7(4-10)12-8/h5H,2H2,1H3
- InChI Key： IMHNTGULOKGBGG-UHFFFAOYSA-N
- SMILES： O(C1C=NC(C#N)=C(C#N)N=1)CC
Computed Properties
- Exact Mass: 174.05416083g/mol
- Monoisotopic Mass: 174.05416083g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 260
- 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
- XLogP3: 0.7
- Topological Polar Surface Area: 82.6
5-ethoxypyrazine-2,3-dicarbonitrile Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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