Cas no 1823340-44-8 (5-(hydroxymethyl)pyrimidine-2-carbaldehyde)
1823340-44-8 structure
Product Name:5-(hydroxymethyl)pyrimidine-2-carbaldehyde
CAS No:1823340-44-8
MF:C6H6N2O2
MW:138.12
CID:4760485
Update Time:2022-10-21
5-(hydroxymethyl)pyrimidine-2-carbaldehyde Chemical and Physical Properties
Names and Identifiers
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- 5-(hydroxymethyl)pyrimidine-2-carbaldehyde
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- Inchi： 1S/C6H6N2O2/c9-3-5-1-7-6(4-10)8-2-5/h1-2,4,9H,3H2
- InChI Key： OXXLQYFFUNNKFV-UHFFFAOYSA-N
- SMILES： C1(C=O)=NC=C(CO)C=N1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
5-(hydroxymethyl)pyrimidine-2-carbaldehyde Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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