Cas no 51507-14-3 (2,6-bis[bis(methylsulfanyl)methylidene]cyclohexanone (Related Reference))
![2,6-bis[bis(methylsulfanyl)methylidene]cyclohexanone (Related Reference) structure](https://ossimg.kuujia.com/scimg/52000/51507-14-3x500.png)
51507-14-3 structure
Product Name:2,6-bis[bis(methylsulfanyl)methylidene]cyclohexanone (Related Reference)
CAS No:51507-14-3
MF:C12H18OS4
MW:306.530718326569
CID:935450
PubChem ID:336611
Update Time:2025-04-19
2,6-bis[bis(methylsulfanyl)methylidene]cyclohexanone (Related Reference) Chemical and Physical Properties
Names and Identifiers
-
- 2,6-bis[bis(methylsulfanyl)methylidene]cyclohexanone (Related Reference)
- 2,6-bis[bis(methylsulfanyl)methylidene]cyclohexan-1-one
- NSC-351528
- NSC351528
- 51507-14-3
- DTXSID30319874
-
- Inchi： 1S/C12H18OS4/c1-14-11(15-2)8-6-5-7-9(10(8)13)12(16-3)17-4/h5-7H2,1-4H3
- InChI Key： PVPZBIDCJFZIFJ-UHFFFAOYSA-N
- SMILES： S(C)/C(=C1/C(/C(=C(\SC)/SC)/CCC/1)=O)/SC
Computed Properties
- Exact Mass: 306.02424
- Monoisotopic Mass: 306.02404989g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 314
- 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: 3.8
- Topological Polar Surface Area: 118?2
Experimental Properties
- PSA: 17.07
2,6-bis[bis(methylsulfanyl)methylidene]cyclohexanone (Related Reference) Related Literature
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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