Cas no 133346-85-7 (1,2,3-trichlorodibenzo[b,d]thiophenato)
![1,2,3-trichlorodibenzo[b,d]thiophenato structure](https://ossimg.kuujia.com/scimg/133500/133346-85-7x500.png)
133346-85-7 structure
Product Name:1,2,3-trichlorodibenzo[b,d]thiophenato
CAS No:133346-85-7
MF:C12H5Cl3S
MW:287.59209895134
CID:1233048
PubChem ID:179928
Update Time:2025-04-20
1,2,3-trichlorodibenzo[b,d]thiophenato Chemical and Physical Properties
Names and Identifiers
-
- 1,2,3-trichlorodibenzo[b,d]thiophenato
- 1,2,3-trichlorodibenzothiophene
- DTXSID70928085
- 1,2,3-Trichlorodibenzo[b,d]thiophene
- Dibenzothiophene, trichloro-
- 133346-85-7
- trichlorodibenzothiophene
-
- Inchi： 1S/C12H5Cl3S/c13-7-5-9-10(12(15)11(7)14)6-3-1-2-4-8(6)16-9/h1-5H
- InChI Key： SOUNRJSGPVUHBX-UHFFFAOYSA-N
- SMILES： ClC1=C(C(=CC2=C1C1C=CC=CC=1S2)Cl)Cl
Computed Properties
- Exact Mass: 285.91795
- Monoisotopic Mass: 285.917754g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 0
- Complexity: 273
- 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: 6.2
- Topological Polar Surface Area: 28.2?2
Experimental Properties
- PSA: 0
1,2,3-trichlorodibenzo[b,d]thiophenato Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
-
Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
-
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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