Cas no 95417-18-8 (8a-Methylhexahydro-5H-[1,3]oxazolo[3,2-c]pyrimidine-5-thione)
![8a-Methylhexahydro-5H-[1,3]oxazolo[3,2-c]pyrimidine-5-thione structure](https://ossimg.kuujia.com/scimg/95500/95417-18-8x500.png)
95417-18-8 structure
Product Name:8a-Methylhexahydro-5H-[1,3]oxazolo[3,2-c]pyrimidine-5-thione
CAS No:95417-18-8
MF:C7H12N2OS
MW:172.247980117798
CID:2818963
PubChem ID:13321168
Update Time:2024-03-01
8a-Methylhexahydro-5H-[1,3]oxazolo[3,2-c]pyrimidine-5-thione Chemical and Physical Properties
Names and Identifiers
-
- 5H-Oxazolo[3,2-c]pyrimidine-5-thione, hexahydro-8a-methyl-
- 8a-Methylhexahydro-5H-[1,3]oxazolo[3,2-c]pyrimidine-5-thione
-
- Inchi： 1S/C7H12N2OS/c1-7-2-3-8-6(11)9(7)4-5-10-7/h2-5H2,1H3,(H,8,11)
- InChI Key： UNDOIXPRTZMWGE-UHFFFAOYSA-N
- SMILES： S=C1NCCC2(C)N1CCO2
Computed Properties
- Exact Mass: 172.06703418g/mol
- Monoisotopic Mass: 172.06703418g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 197
- 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: 0.3
- Topological Polar Surface Area: 56.6
8a-Methylhexahydro-5H-[1,3]oxazolo[3,2-c]pyrimidine-5-thione Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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5. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
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