1843-05-6 Purity
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Specification
The molecular formula of 4,4-Thiodibenzenethiol is C12H10S3.
The molecular weight of 4,4-Thiodibenzenethiol is 250.4 g/mol.
The IUPAC name of 4,4-Thiodibenzenethiol is 4-(4-sulfanylphenyl)sulfanylbenzenethiol.
The InChI of 4,4-Thiodibenzenethiol is InChI=1S/C12H10S3/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8,13-14H.
The InChIKey of 4,4-Thiodibenzenethiol is JLLMOYPIVVKFHY-UHFFFAOYSA-N.
The canonical SMILES of 4,4-Thiodibenzenethiol is C1=CC(=CC=C1S)SC2=CC=C(C=C2)S.
The CAS number of 4,4-Thiodibenzenethiol is 19362-77-7.
The XLogP3 of 4,4-Thiodibenzenethiol is 4.4.
The hydrogen bond donor count of 4,4-Thiodibenzenethiol is 2.
The hydrogen bond acceptor count of 4,4-Thiodibenzenethiol is 3.
Reference: [1]Russian Journal of Organic Chemistry,1998,vol. 34,p. 1160 - 1164
[2]Synthetic Communications,1998,vol. 28,p. 197 - 199
[3]Yakugaku Zasshi/Journal of the Pharmaceutical Society of Japan,1949,vol. 69,p. 403
Chem.Abstr.,1950,p. 1922
Reference: [1]Journal of Organic Chemistry USSR (English Translation),1992,vol. 28,p. 1526 - 1530
Zhurnal Organicheskoi Khimii,1992,vol. 28,p. 1905 - 1910
[2]Patent: US2019/15301,2019,A1 .Location in patent: Paragraph 0087; 0088
* For details of the synthesis route, please refer to the original source to ensure accuracy.