Cas no 30066-93-4 (2,4,6(1H,3H,5H)-Pyrimidinetrione,5-amino-1,3-dimethyl-)
30066-93-4 structure
Product Name:2,4,6(1H,3H,5H)-Pyrimidinetrione,5-amino-1,3-dimethyl-
CAS No:30066-93-4
MF:C6H9N3O3
MW:171.153960943222
CID:317672
PubChem ID:264936
Update Time:2025-04-19
2,4,6(1H,3H,5H)-Pyrimidinetrione,5-amino-1,3-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-amino-1,3-dimethyl-
- 5-amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione
- SCHEMBL11820394
- 30066-93-4
- NSC-100618
- 5-amino-1,3-dimethylbarbituric acid
- NCIOpen2_002105
- DTXSID80952477
- NSC100618
- Benzenamine,N-bis(2-chloroethyl)-4-[[[4-[2-[(4-methoxyphenyl)methyl]-4-thiazoyl]phenyl]imino]methyl]-, monohydrochloride
-
- Inchi： 1S/C6H9N3O3/c1-8-4(10)3(7)5(11)9(2)6(8)12/h3H,7H2,1-2H3
- InChI Key： COUUESOYZDECCM-UHFFFAOYSA-N
- SMILES： O=C1C(C(N(C)C(N1C)=O)=O)N
Computed Properties
- Exact Mass: 171.06447
- Monoisotopic Mass: 171.06439116g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 239
- 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: -1.6
- Topological Polar Surface Area: 83.7?2
Experimental Properties
- PSA: 83.71
2,4,6(1H,3H,5H)-Pyrimidinetrione,5-amino-1,3-dimethyl- Related Literature
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Ying Li,Weirong Yao,Yunfei Xie,Renjun Pei RSC Adv., 2015,5, 98724-98729
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
30066-93-4 (2,4,6(1H,3H,5H)-Pyrimidinetrione,5-amino-1,3-dimethyl-) Related Products
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