Cas no 2432-92-0 (Pentanethioic acid, S-ethyl ester)
2432-92-0 structure
Product Name:Pentanethioic acid, S-ethyl ester
CAS No:2432-92-0
MF:C7H14OS
MW:146.250461101532
CID:1416975
PubChem ID:520118
Update Time:2025-04-20
Pentanethioic acid, S-ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Pentanethioic acid, S-ethyl ester
- S-ethyl pentanethioate
- CGRFTVFWSJEHCI-UHFFFAOYSA-N
- S-Ethyl pentanethioate #
- DTXSID60334252
- Valeric acid, thio-, S-ethyl ester
- 2432-92-0
-
- Inchi： 1S/C7H14OS/c1-3-5-6-7(8)9-4-2/h3-6H2,1-2H3
- InChI Key： CGRFTVFWSJEHCI-UHFFFAOYSA-N
- SMILES： S(CC)C(CCCC)=O
Computed Properties
- Exact Mass: 146.07662
- Monoisotopic Mass: 146.07653624g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 5
- Complexity: 81
- 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: 42.4?2
Experimental Properties
- PSA: 17.07
Pentanethioic acid, S-ethyl ester Related Literature
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
2432-92-0 (Pentanethioic acid, S-ethyl ester) Related Products
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- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
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