Cas no 22051-80-5 (Pyrazinetetracarboxamide)
Pyrazinetetracarboxamide structure
Product Name:Pyrazinetetracarboxamide
CAS No:22051-80-5
MF:C8H8N6O4
MW:252.186920166016
CID:1406083
PubChem ID:3401752
Update Time:2025-04-20
Pyrazinetetracarboxamide Chemical and Physical Properties
Names and Identifiers
-
- Pyrazinetetracarboxamide
- pyrazine-2,3,5,6-tetracarboxamide
- SCHEMBL8951079
- DTXSID20392156
- 22051-80-5
-
- Inchi： 1S/C8H8N6O4/c9-5(15)1-2(6(10)16)14-4(8(12)18)3(13-1)7(11)17/h(H2,9,15)(H2,10,16)(H2,11,17)(H2,12,18)
- InChI Key： VAPLSNGCBVVBQG-UHFFFAOYSA-N
- SMILES： O=C(C1C(C(N)=O)=NC(C(N)=O)=C(C(N)=O)N=1)N
Computed Properties
- Exact Mass: 252.06084
- Monoisotopic Mass: 252.061
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 336
- 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: -3.4
- Topological Polar Surface Area: 198?2
Experimental Properties
- PSA: 198.14
Pyrazinetetracarboxamide Related Literature
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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