Cas no 18197-22-3 (Formamide, N-formyl-(9CI))
Formamide, N-formyl-(9CI) structure
Product Name:Formamide, N-formyl-(9CI)
Formamide, N-formyl-(9CI) Chemical and Physical Properties
Names and Identifiers
-
- Formamide, N-formyl-(9CI)
- IMINOALDEHYDE
- N-formylformamide
- BRN 1736856
- Diformamide
- Diformylamine
- Formaldehyde, iminobis-
- Formamide, N-formyl-
- Formimidol
- N-Formylformimidic acid
- DTXSID80171222
- 18197-22-3
- 1-02-00-00022 (Beilstein Handbook Reference)
- AKOS006279605
- N-hydroxy methylene formamide
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- Inchi: 1S/C2H3NO2/c4-1-3-2-5/h1-2H,(H,3,4,5)
- InChI Key: AIDQCFHFXWPAFG-UHFFFAOYSA-N
- SMILES: O=CNC=O
Computed Properties
- Exact Mass: 73.01639
- Monoisotopic Mass: 73.016378338g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 5
- Rotatable Bond Count: 0
- Complexity: 36.9
- 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: 46.2?2
Experimental Properties
- Density: 1.3248 (rough estimate)
- Melting Point: 41.5°C
- Boiling Point: 128.84°C (rough estimate)
- Refractive Index: 1.4200 (estimate)
- PSA: 49.66
Formamide, N-formyl-(9CI) Related Literature
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Zhengyi Li,Zhaozhuo Yu,Xiaoxiang Luo,Chuanhui Li,Hongguo Wu,Wenfeng Zhao,Hu Li,Song Yang RSC Adv. 2020 10 33972
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Arne Joakim C. Bunkan,Jens Hetzler,Tomá? Mikoviny,Armin Wisthaler,Claus J. Nielsen,Matthias Olzmann Phys. Chem. Chem. Phys. 2015 17 7046
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3. Complementary hydrogen bonding in diamides: a study on the influence of remote substituents using density functional theoryJohn E. McGrady,D. Michael P. Mingos J. Chem. Soc. Perkin Trans. 2 1995 2287
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Milán Sz?ri,Balázs Jójárt,Róbert Izsák,Kornél Sz?ri,Imre G. Csizmadia,Béla Viskolcz Phys. Chem. Chem. Phys. 2011 13 7449
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5. Rotational barriers in tetraformylhydrazineJames A. Platts,Michael P. Coogan J. Chem. Soc. Perkin Trans. 2 2000 1075
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