Cas no 2080-16-2 (4(3H)-Pyrimidinone, 2-(dimethylamino)-3-methyl-)
2080-16-2 structure
Product Name:4(3H)-Pyrimidinone, 2-(dimethylamino)-3-methyl-
CAS No:2080-16-2
MF:C7H11N3O
MW:153.181740999222
CID:1396258
Update Time:2024-08-16
4(3H)-Pyrimidinone, 2-(dimethylamino)-3-methyl- Chemical and Physical Properties
Names and Identifiers
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- 4(3H)-Pyrimidinone, 2-(dimethylamino)-3-methyl-
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- Inchi： 1S/C7H11N3O/c1-9(2)7-8-5-4-6(11)10(7)3/h4-5H,1-3H3
- InChI Key： YPOIQSAIQUUCCU-UHFFFAOYSA-N
- SMILES： C1(N(C)C)=NC=CC(=O)N1C
Computed Properties
- Exact Mass: 153.09033
Experimental Properties
- Density: 1.11±0.1 g/cm3(Predicted)
- Melting Point: 95-96 °C(Solv: ethyl acetate (141-78-6); ligroine (8032-32-4))
- Boiling Point: 108 °C(Press: 1 Torr)
- PSA: 35.91
- pka: 4.03±0.68(Predicted)
4(3H)-Pyrimidinone, 2-(dimethylamino)-3-methyl- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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