Cas no 304646-52-4 (4(3H)-Pyrimidinone,5-amino-6-methoxy-2-methyl-)
304646-52-4 structure
Product Name:4(3H)-Pyrimidinone,5-amino-6-methoxy-2-methyl-
CAS No:304646-52-4
MF:C6H9N3O2
MW:155.154560804367
CID:299537
PubChem ID:2337572
Update Time:2025-04-19
4(3H)-Pyrimidinone,5-amino-6-methoxy-2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 4(3H)-Pyrimidinone,5-amino-6-methoxy-2-methyl-
- 4(1H)-Pyrimidinone,5-amino-6-methoxy-2-methyl- (9CI)
- 304646-52-4
- HMS1784O06
- Z56767609
- 5-Amino-6-methoxy-2-methylpyrimidin-4(3H)-one
-
- Inchi： 1S/C6H9N3O2/c1-3-8-5(10)4(7)6(9-3)11-2/h7H2,1-2H3,(H,8,9,10)
- InChI Key： PLHUXAKWCCRUDM-UHFFFAOYSA-N
- SMILES： O(C)C1=C(C(NC(C)=N1)=O)N
Computed Properties
- Exact Mass: 155.06957
- Monoisotopic Mass: 155.069
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 255
- 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
- Topological Polar Surface Area: 76.7?2
Experimental Properties
- PSA: 76.71
4(3H)-Pyrimidinone,5-amino-6-methoxy-2-methyl- Related Literature
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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