Cas no 19759-75-2 (Propanoic acid,3-(dodecylthio)-, methyl ester)
19759-75-2 structure
Product Name:Propanoic acid,3-(dodecylthio)-, methyl ester
CAS No:19759-75-2
MF:C16H32O2S
MW:288.489084243774
CID:179154
PubChem ID:88227
Update Time:2025-04-19
Propanoic acid,3-(dodecylthio)-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid,3-(dodecylthio)-, methyl ester
- methyl 3-(dodecylthio)propionate
- methyl 3-(dodecylsulfanyl)propanoate
- Methyl 3-(laurylthio)propionate
- Methyl 3-dodecylthiopropanoate
- Einecs 243-274-9
- 3-(Dodecylthio)propionic acid methyl ester
- Propanoic acid, 3-(dodecylthio)-, methyl ester
- NS00026422
- VSIGYUOJAOCSKU-UHFFFAOYSA-N
- DTXSID6066525
- 19759-75-2
- 3-(n-dodecylthio)-propanoic acid, methyl ester
- methyl 3-dodecylsulfanylpropanoate
- SCHEMBL268172
-
- Inchi： 1S/C16H32O2S/c1-3-4-5-6-7-8-9-10-11-12-14-19-15-13-16(17)18-2/h3-15H2,1-2H3
- InChI Key： VSIGYUOJAOCSKU-UHFFFAOYSA-N
- SMILES： S(CCC(=O)OC)CCCCCCCCCCCC
Computed Properties
- Exact Mass: 288.21246
- Monoisotopic Mass: 288.21230143g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 15
- Complexity: 195
- 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: 6.3
- Topological Polar Surface Area: 51.6?2
Experimental Properties
- PSA: 26.3
Propanoic acid,3-(dodecylthio)-, methyl ester Related Literature
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
19759-75-2 (Propanoic acid,3-(dodecylthio)-, methyl ester) Related Products
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