Cas no 1314077-24-1 (5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carbothioamide)
1314077-24-1 structure
Product Name:5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carbothioamide
CAS No:1314077-24-1
MF:C15H21NS
MW:247.398942708969
CID:2124628
Update Time:2023-08-04
5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carbothioamide Chemical and Physical Properties
Names and Identifiers
-
- 5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carbothioamide
- 2-Naphthalenecarbothioamide, 5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-
- 5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carbothioamide
-
- Inchi： 1S/C15H21NS/c1-14(2)7-8-15(3,4)12-9-10(13(16)17)5-6-11(12)14/h5-6,9H,7-8H2,1-4H3,(H2,16,17)
- InChI Key： UDSOVVNYUGZVQP-UHFFFAOYSA-N
- SMILES： S=C(C1C=CC2=C(C=1)C(C)(C)CCC2(C)C)N
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 319
- Topological Polar Surface Area: 58.1
5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carbothioamide Related Literature
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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4. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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