Cas no 89375-31-5 (1,2,3-Benzenetrithiol)
1,2,3-Benzenetrithiol structure
Product Name:1,2,3-Benzenetrithiol
CAS No:89375-31-5
MF:C6H6S3
MW:174.306837558746
CID:602702
PubChem ID:21558276
Update Time:2025-04-19
1,2,3-Benzenetrithiol Chemical and Physical Properties
Names and Identifiers
-
- 1,2,3-Benzenetrithiol
- benzene-1,2,3-trithiol
- 89375-31-5
- Trimerkaptobenzol
- SCHEMBL332474
- DTXSID20615852
-
- Inchi： 1S/C6H6S3/c7-4-2-1-3-5(8)6(4)9/h1-3,7-9H
- InChI Key： PPQNMKIMOCEJIR-UHFFFAOYSA-N
- SMILES： SC1C(=CC=CC=1S)S
Computed Properties
- Exact Mass: 173.96316371g/mol
- Monoisotopic Mass: 173.96316371g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 84.3
- 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: 2.4
- Topological Polar Surface Area: 3?2
1,2,3-Benzenetrithiol Related Literature
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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