Cas no 1073-82-1 (2(1H)-Pyrimidinone,6-amino-3,4-dihydro-4-thioxo-)
1073-82-1 structure
Product Name:2(1H)-Pyrimidinone,6-amino-3,4-dihydro-4-thioxo-
CAS No:1073-82-1
MF:C4H5N3OS
MW:143.166998624802
CID:170916
PubChem ID:1550879
Update Time:2025-04-19
2(1H)-Pyrimidinone,6-amino-3,4-dihydro-4-thioxo- Chemical and Physical Properties
Names and Identifiers
-
- 2(1H)-Pyrimidinone,6-amino-3,4-dihydro-4-thioxo-
- 2(1H)-Pyrimidinone, 6-amino-3,4-dihydro-4-thioxo- (9CI)
- 6-amino-4-sulfanylidene-1H-pyrimidin-2-one
- 4-Amino-2-hydroxy-6-mercapto-pyrimidin
- 6-amino-4-thioxo-3,4-dihydro-1H-pyrimidin-2-one
- 6-amino-4-thioxo-3,4-dihydropyrimidin-2(1H)-one
- AB-323
- AC1LT44Z
- CTK7D5609
- NSC45722
- SureCN2491099
- Uracil, 6-amino-4-thio-
- 4-AMINO-2-HYDROXY-6-MERCAPTOPYRIMIDINE
- AKOS006338485
- 6-amino-4-sulfanylidene-1,2,3,4-tetrahydropyrimidin-2-one
- 2(1H)-Pyrimidinone, 6-amino-3,4-dihydro-4-thioxo-
- 2,3H)-Pyrimidinedione, 6-amino-4-thio-
- 1073-82-1
- 6-Amino-3,4-dihydro-4-thioxo-2(1H)-pyrimidinone
- NSC-45722
- DTXSID70364343
- AKOS025117060
- 6-thiocytosine
- SCHEMBL1765938
- 2,4(1H,3H)-Pyrimidinedione, 6-amino-4-thio-
- SCHEMBL10402369
- 4-amino-6-mercapto-2-pyrimidinol
- 4-Amino-6-mercaptopyrimidin-2-ol
- 3WN7EV3PRL
-
- Inchi： 1S/C4H5N3OS/c5-2-1-3(9)7-4(8)6-2/h1H,(H4,5,6,7,8,9)
- InChI Key： DICDUABQXBWBLE-UHFFFAOYSA-N
- SMILES： S=C1C=C(N)NC(N1)=O
Computed Properties
- Exact Mass: 143.01545
- Monoisotopic Mass: 143.015
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 198
- 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
- Topological Polar Surface Area: 99.2?2
- Surface Charge: 0
- Tautomer Count: 17
- XLogP3: nothing
Experimental Properties
- Density: 1.56
- Boiling Point: 521.6°Cat760mmHg
- Flash Point: 269.2°C
- Refractive Index: 1.727
- PSA: 67.15
- LogP: 0.59590
2(1H)-Pyrimidinone,6-amino-3,4-dihydro-4-thioxo- Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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