Cas no 183997-71-9 (2,5-diformyl-1H-Pyrrole-3-carbonitrile)
183997-71-9 structure
Product Name:2,5-diformyl-1H-Pyrrole-3-carbonitrile
CAS No:183997-71-9
MF:C7H4N2O2
MW:148.118861198425
CID:114219
PubChem ID:10844528
Update Time:2025-04-18
2,5-diformyl-1H-Pyrrole-3-carbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 2,5-diformyl-1H-Pyrrole-3-carbonitrile
- 1H-Pyrrole-3-carbonitrile,2,5-diformyl-
- 1H-Pyrrole-3-carbonitrile, 2,5-diformyl- (9CI)
- 183997-71-9
-
- Inchi： 1S/C7H4N2O2/c8-2-5-1-6(3-10)9-7(5)4-11/h1,3-4,9H
- InChI Key： SMANBJWSHLOZJE-UHFFFAOYSA-N
- SMILES： O=CC1=C(C#N)C=C(C=O)N1
Computed Properties
- Exact Mass: 148.02732
- Monoisotopic Mass: 148.027277375g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 218
- 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
- Topological Polar Surface Area: 73.7?2
Experimental Properties
- PSA: 73.72
2,5-diformyl-1H-Pyrrole-3-carbonitrile Related Literature
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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