Cas no 51762-85-7 (1,4-Benzenedicarboxylic acid, 2-[(4-methylphenyl)thio]-)
![1,4-Benzenedicarboxylic acid, 2-[(4-methylphenyl)thio]- structure](https://ossimg.kuujia.com/scimg/52000/51762-85-7x500.png)
51762-85-7 structure
Product Name:1,4-Benzenedicarboxylic acid, 2-[(4-methylphenyl)thio]-
CAS No:51762-85-7
MF:C15H12O4S
MW:288.318383216858
CID:361478
PubChem ID:10589422
Update Time:2025-04-19
1,4-Benzenedicarboxylic acid, 2-[(4-methylphenyl)thio]- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Benzenedicarboxylic acid, 2-[(4-methylphenyl)thio]-
- 2-(4-methylphenyl)sulfanylterephthalic acid
- DTXSID60442225
- SCHEMBL4543187
- 2-(4-Methylthiophenoxy)terephthalic acid
- 51762-85-7
- 2-(p-tolylthio)benzene-1,4-dicarboxylic acid
- VUSUSPDOEWNKCH-UHFFFAOYSA-N
-
- Inchi： 1S/C15H12O4S/c1-9-2-5-11(6-3-9)20-13-8-10(14(16)17)4-7-12(13)15(18)19/h2-8H,1H3,(H,16,17)(H,18,19)
- InChI Key： VUSUSPDOEWNKCH-UHFFFAOYSA-N
- SMILES： S(C1C=CC(C)=CC=1)C1C=C(C(=O)O)C=CC=1C(=O)O
Computed Properties
- Exact Mass: 288.04566
- Monoisotopic Mass: 288.04563003g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 363
- 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: 3.4
- Topological Polar Surface Area: 99.9?2
Experimental Properties
- PSA: 74.6
1,4-Benzenedicarboxylic acid, 2-[(4-methylphenyl)thio]- Related Literature
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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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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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
51762-85-7 (1,4-Benzenedicarboxylic acid, 2-[(4-methylphenyl)thio]-) Related Products
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