Cas no 59962-53-7 (N-(5-(1,1-Dimethylethyl)-1,3,4-thiadiazol-2-yl)-N-methylurea)
59962-53-7 structure
Product Name:N-(5-(1,1-Dimethylethyl)-1,3,4-thiadiazol-2-yl)-N-methylurea
CAS No:59962-53-7
MF:C8H14N4OS
MW:214.287959575653
CID:950975
Update Time:2023-08-02
N-(5-(1,1-Dimethylethyl)-1,3,4-thiadiazol-2-yl)-N-methylurea Chemical and Physical Properties
Names and Identifiers
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- Urea, N-5-(1,1-dimethylethyl)-1,3,4-thiadiazol-2-yl-N-methyl-
- N-(5-(1,1-Dimethylethyl)-1,3,4-thiadiazol-2-yl)-N-methylurea
- 5C8S1I27S1
- Urea, N-(5-(1,1-dimethylethyl)-1,3,4-thiadiazol-2-yl)-N-methyl-
- Q27261826
- 1-(5-tert-Butyl-1,3,4-thiadiazol-2-yl)-1-methylurea
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- Inchi: 1S/C8H14N4OS/c1-8(2,3)5-10-11-7(14-5)12(4)6(9)13/h1-4H3,(H2,9,13)
- InChI Key: UBBJYJXRQJNARS-UHFFFAOYSA-N
- SMILES: S1C(=NN=C1C(C)(C)C)N(C(N)=O)C
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 228
- Topological Polar Surface Area: 100
N-(5-(1,1-Dimethylethyl)-1,3,4-thiadiazol-2-yl)-N-methylurea Related Literature
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Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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