Cas no 65113-46-4 (4,10-Dimethyl-1,7-dithia-4,10-diazacyclododecane)
65113-46-4 structure
Product Name:4,10-Dimethyl-1,7-dithia-4,10-diazacyclododecane
CAS No:65113-46-4
MF:C10H22N2S2
MW:234.42507982254
CID:2793381
PubChem ID:23422515
Update Time:2025-04-21
4,10-Dimethyl-1,7-dithia-4,10-diazacyclododecane Chemical and Physical Properties
Names and Identifiers
-
- 4,10-Dimethyl-1,7-dithia-4,10-diazacyclododecane
- DTXCID50584587
- 65113-46-4
- DTXSID80633835
-
- Inchi： 1S/C10H22N2S2/c1-11-3-7-13-9-5-12(2)6-10-14-8-4-11/h3-10H2,1-2H3
- InChI Key： WRBSEYSASLSSRW-UHFFFAOYSA-N
- SMILES： S1CCN(C)CCSCCN(C)CC1
Computed Properties
- Exact Mass: 234.12244106Da
- Monoisotopic Mass: 234.12244106Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 116
- 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
- XLogP3: 1.4
- Topological Polar Surface Area: 57.1?2
4,10-Dimethyl-1,7-dithia-4,10-diazacyclododecane Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
65113-46-4 (4,10-Dimethyl-1,7-dithia-4,10-diazacyclododecane) Related Products
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