Cas no 19813-93-5 (Acetic acid, ([1,1'-biphenyl]-4-ylthio)-)
![Acetic acid, ([1,1'-biphenyl]-4-ylthio)- structure](https://ossimg.kuujia.com/scimg/20000/19813-93-5x500.png)
19813-93-5 structure
Product Name:Acetic acid, ([1,1'-biphenyl]-4-ylthio)-
CAS No:19813-93-5
MF:C14H12O2S
MW:244.308882713318
CID:1390200
PubChem ID:515126
Update Time:2025-04-20
Acetic acid, ([1,1'-biphenyl]-4-ylthio)- Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid, ([1,1'-biphenyl]-4-ylthio)-
- SCHEMBL7046401
- 2-(4-phenylphenyl)sulfanylacetic acid
- 2-([1,1a(2)-Biphenyl]-4-ylthio)acetic acid
- DTXSID301280183
- (Biphenyl-4-sulfanyl)-acetic acid
- CHEMBL177787
- BDBM50137881
- 19813-93-5
- JUOJESMBZPRKIA-UHFFFAOYSA-N
- (Biphenyl-4-ylsulfanyl)-acetic acid
- 2-(biphenyl-4-ylsulfanyl)-acetic acid
-
- Inchi： 1S/C14H12O2S/c15-14(16)10-17-13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9H,10H2,(H,15,16)
- InChI Key： JUOJESMBZPRKIA-UHFFFAOYSA-N
- SMILES： S(CC(=O)O)C1C=CC(=CC=1)C1C=CC=CC=1
Computed Properties
- Exact Mass: 244.05586
- Monoisotopic Mass: 244.05580079g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 241
- 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: 3.5
- Topological Polar Surface Area: 62.6?2
Experimental Properties
- PSA: 37.3
Acetic acid, ([1,1'-biphenyl]-4-ylthio)- Related Literature
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
19813-93-5 (Acetic acid, ([1,1'-biphenyl]-4-ylthio)-) Related Products
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