Cas no 76574-49-7 (5-Pyrimidinecarboxaldehyde,4,6-diamino-2-methyl-)
76574-49-7 structure
Product Name:5-Pyrimidinecarboxaldehyde,4,6-diamino-2-methyl-
CAS No:76574-49-7
MF:C6H8N4O
MW:152.153920173645
CID:561417
PubChem ID:73011493
Update Time:2025-04-19
5-Pyrimidinecarboxaldehyde,4,6-diamino-2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 5-Pyrimidinecarboxaldehyde,4,6-diamino-2-methyl-
- 4,6-diamino-2-methylpyrimidine-5-carbaldehyde
- 76574-49-7
-
- Inchi： 1S/C6H8N4O/c1-3-9-5(7)4(2-11)6(8)10-3/h2H,1H3,(H4,7,8,9,10)
- InChI Key： AXKUSRDZOMGBTG-UHFFFAOYSA-N
- SMILES： O=CC1=C(N)N=C(C)N=C1N
Computed Properties
- Exact Mass: 152.06981089g/mol
- Monoisotopic Mass: 152.06981089g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 140
- 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: -0.1
- Topological Polar Surface Area: 94.9?2
5-Pyrimidinecarboxaldehyde,4,6-diamino-2-methyl- Related Literature
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
76574-49-7 (5-Pyrimidinecarboxaldehyde,4,6-diamino-2-methyl-) Related Products
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