Cas no 27970-36-1 (Sodium S-octyl sulfurothioate)
Sodium S-octyl sulfurothioate structure
Product Name:Sodium S-octyl sulfurothioate
CAS No:27970-36-1
MF:C8H17NaO3S2
MW:248.338551282883
CID:2929724
Update Time:2023-08-10
Sodium S-octyl sulfurothioate Chemical and Physical Properties
Names and Identifiers
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- Sodium S-octyl sulfurothioate
- Thiosulfuric acid O-sodium S-octyl ester salt
- Sodium S-(3-carboxy-4-nitrophenyl) sulfurothioate
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- Inchi： 1S/C8H18O3S2.Na/c1-2-3-4-5-6-7-8-12-13(9,10)11;/h2-8H2,1H3,(H,9,10,11);/q;+1/p-1
- InChI Key： JCQNUUBOAHPREK-UHFFFAOYSA-M
- SMILES： S(CCCCCCCC)S(=O)(=O)[O-].[Na+]
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 8
- Complexity: 199
- Topological Polar Surface Area: 90.9
Sodium S-octyl sulfurothioate Related Literature
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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