Cas no 94427-97-1 (1H-Pyrazole-3,4-dicarbonitrile, 5-amino-1-phenyl-)
94427-97-1 structure
Product Name:1H-Pyrazole-3,4-dicarbonitrile, 5-amino-1-phenyl-
CAS No:94427-97-1
MF:C11H7N5
MW:209.206780672073
CID:1984013
PubChem ID:767375
Update Time:2025-04-21
1H-Pyrazole-3,4-dicarbonitrile, 5-amino-1-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazole-3,4-dicarbonitrile, 5-amino-1-phenyl-
- 5-amino-1-phenylpyrazole-3,4-dicarbonitrile
- DTXSID80354255
- STK862914
- SR-01000397898-1
- AKOS000100853
- 5-Amino-1-phenyl-1H-pyrazole-3,4-dicarbonitrile
- 94427-97-1
- DTXCID10305316
- SR-01000397898
-
- Inchi： 1S/C11H7N5/c12-6-9-10(7-13)15-16(11(9)14)8-4-2-1-3-5-8/h1-5H,14H2
- InChI Key： MGULYLNXXBGXJR-UHFFFAOYSA-N
- SMILES： N1(C(=C(C#N)C(C#N)=N1)N)C1C=CC=CC=1
Computed Properties
- Exact Mass: 209.07014524Da
- Monoisotopic Mass: 209.07014524Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 342
- 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: 1.9
- Topological Polar Surface Area: 91.4?2
1H-Pyrazole-3,4-dicarbonitrile, 5-amino-1-phenyl- Related Literature
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
94427-97-1 (1H-Pyrazole-3,4-dicarbonitrile, 5-amino-1-phenyl-) Related Products
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