Cas no 7391-67-5 (1,5-dimethylbarbituric acid)
1,5-dimethylbarbituric acid structure
Product Name:1,5-dimethylbarbituric acid
CAS No:7391-67-5
MF:C6H8N2O3
MW:156.139321327209
CID:862940
PubChem ID:151461
Update Time:2025-04-19
1,5-dimethylbarbituric acid Chemical and Physical Properties
Names and Identifiers
-
- 1,5-dimethylbarbituric acid
- 2,4,6(1H,3H,5H)-pyrimidinetrione, 1,5-dimethyl-
- 1,5-dimethyl-1,3-diazinane-2,4,6-trione
- DTXSID00995068
- 7391-67-5
- 1,5-Dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
- DABBHRQKJNIVFT-UHFFFAOYSA-N
- 6-Hydroxy-3,5-dimethylpyrimidine-2,4(3H,5H)-dione
- SCHEMBL8986116
- SCHEMBL1263088
- 1,5-Dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione #
-
- Inchi： 1S/C6H8N2O3/c1-3-4(9)7-6(11)8(2)5(3)10/h3H,1-2H3,(H,7,9,11)
- InChI Key： DABBHRQKJNIVFT-UHFFFAOYSA-N
- SMILES： O=C1C(C)C(NC(N1C)=O)=O
Computed Properties
- Exact Mass: 156.05354
- Monoisotopic Mass: 156.05349212g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 236
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.2
- Topological Polar Surface Area: 66.5?2
Experimental Properties
- PSA: 66.48
1,5-dimethylbarbituric acid Related Literature
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
7391-67-5 (1,5-dimethylbarbituric acid) Related Products
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- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
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