Cas no 72111-80-9 (5-Methoxypyrazine-2,3-dicarbonitrile)
72111-80-9 structure
Product Name:5-Methoxypyrazine-2,3-dicarbonitrile
CAS No:72111-80-9
MF:C7H4N4O
MW:160.132860183716
CID:2671541
Update Time:2023-08-06
5-Methoxypyrazine-2,3-dicarbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 5-methoxypyrazine-2,3-dicarbonitrile
- AB60485
- 5-Methoxypyrazine-2,3-dicarbonitrile
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- Inchi： 1S/C7H4N4O/c1-12-7-4-10-5(2-8)6(3-9)11-7/h4H,1H3
- InChI Key： ULBOSMFXVAUSSC-UHFFFAOYSA-N
- SMILES： O(C)C1C=NC(C#N)=C(C#N)N=1
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 247
- XLogP3: 0.3
- Topological Polar Surface Area: 82.6
5-Methoxypyrazine-2,3-dicarbonitrile Related Literature
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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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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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