Cas no 2432-43-1 (Propanethioic acid,S-propyl ester)
2432-43-1 structure
Product Name:Propanethioic acid,S-propyl ester
Propanethioic acid,S-propyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanethioic acid,S-propyl ester
- S-propyl propanethioate
- Propionic acid, thio-, S-propyl ester
- Propyl thiolpropionate
- Propyl thiopropionate
- 2432-43-1
- S-Propyl propanethioate #
- CLBGDLKFLYZLDQ-UHFFFAOYSA-N
- EINECS 219-406-6
- DTXSID60179064
- ethanthiocarboxylic acid S-propylester
- NS00027617
- Propanethioic acid, S-propyl ester
- SCHEMBL6238243
- UNII-ESU6U84QFH
- ESU6U84QFH
-
- MDL： MFCD00039938
- Inchi： 1S/C6H12OS/c1-3-5-8-6(7)4-2/h3-5H2,1-2H3
- InChI Key： CLBGDLKFLYZLDQ-UHFFFAOYSA-N
- SMILES： S(C(CC)=O)CCC
Computed Properties
- Exact Mass: 132.06096
- Monoisotopic Mass: 132.06088618g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 8
- Rotatable Bond Count: 4
- Complexity: 70.9
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 2
- Topological Polar Surface Area: 42.4?2
Experimental Properties
- PSA: 17.07
Propanethioic acid,S-propyl ester Related Literature
-
Bogdan Cojocaru,?tefan Nea?u,Vasile I. Parvulescu,Karifala Dumbuya,Hans-Peter Steinrück,J. Michael Gottfried,Carmela Aprile,Hermenegildo Garcia,J. C. Scaiano Phys. Chem. Chem. Phys. 2009 11 5569
2432-43-1 (Propanethioic acid,S-propyl ester) Related Products
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