Cas no 63290-58-4 (5-[4-Chloro-3-[(1,3-dioxo-2-benzofuran-5-yl)sulfanyl]phenyl]sulfanyl-2-benzofuran-1,3-dione)
63290-58-4 structure
Product Name:5-[4-Chloro-3-[(1,3-dioxo-2-benzofuran-5-yl)sulfanyl]phenyl]sulfanyl-2-benzofuran-1,3-dione
CAS No:63290-58-4
MF:C22H9ClO6S2
MW:468.886262655258
CID:2790273
PubChem ID:71373005
Update Time:2025-04-21
5-[4-Chloro-3-[(1,3-dioxo-2-benzofuran-5-yl)sulfanyl]phenyl]sulfanyl-2-benzofuran-1,3-dione Chemical and Physical Properties
Names and Identifiers
-
- 5,5'-[(4-Chloro-1,3-phenylene)disulfanediyl]di(2-benzofuran-1,3-dione)
- DTXSID40795847
- 63290-58-4
- 5-[4-Chloro-3-[(1,3-dioxo-2-benzofuran-5-yl)sulfanyl]phenyl]sulfanyl-2-benzofuran-1,3-dione
-
- Inchi: 1S/C22H9ClO6S2/c23-17-6-3-12(30-10-1-4-13-15(7-10)21(26)28-19(13)24)9-18(17)31-11-2-5-14-16(8-11)22(27)29-20(14)25/h1-9H
- InChI Key: ZSLHCOJWRDLKDI-UHFFFAOYSA-N
- SMILES: ClC1=CC=C(C=C1SC1C=CC2C(=O)OC(C=2C=1)=O)SC1C=CC2C(=O)OC(C=2C=1)=O
Computed Properties
- Exact Mass: 467.9529080Da
- Monoisotopic Mass: 467.9529080Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 31
- Rotatable Bond Count: 4
- Complexity: 790
- 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: 5.4
- Topological Polar Surface Area: 137?2
5-[4-Chloro-3-[(1,3-dioxo-2-benzofuran-5-yl)sulfanyl]phenyl]sulfanyl-2-benzofuran-1,3-dione Related Literature
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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