Cas no 141358-10-3 (Benzoic acid, 4-[(3-chlorophenyl)thio]-)
![Benzoic acid, 4-[(3-chlorophenyl)thio]- structure](https://ossimg.kuujia.com/scimg/141500/141358-10-3x500.png)
141358-10-3 structure
Product Name:Benzoic acid, 4-[(3-chlorophenyl)thio]-
CAS No:141358-10-3
MF:C13H9ClO2S
MW:264.727361440659
CID:1312093
PubChem ID:15727829
Update Time:2025-04-20
Benzoic acid, 4-[(3-chlorophenyl)thio]- Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 4-[(3-chlorophenyl)thio]-
- 4-(3-Chloro-phenylsulfanyl)benzoic acid
- AKOS006237304
- 141358-10-3
- SCHEMBL692675
- 4-[(3-Chlorophenyl)thio]benzoic acid
- DTXSID701288915
- KYOJRVYVSOZSNG-UHFFFAOYSA-N
-
- Inchi： 1S/C13H9ClO2S/c14-10-2-1-3-12(8-10)17-11-6-4-9(5-7-11)13(15)16/h1-8H,(H,15,16)
- InChI Key： KYOJRVYVSOZSNG-UHFFFAOYSA-N
- SMILES： ClC1=CC=CC(=C1)SC1C=CC(C(=O)O)=CC=1
Computed Properties
- Exact Mass: 264.00127
- Monoisotopic Mass: 264.0011784g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 264
- 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: 4.7
- Topological Polar Surface Area: 62.6?2
Experimental Properties
- PSA: 37.3
Benzoic acid, 4-[(3-chlorophenyl)thio]- Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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