Cas no 18224-54-9 (2-Propenoic acid, 3,3-bis(ethylthio)-, ethyl ester)
18224-54-9 structure
Product Name:2-Propenoic acid, 3,3-bis(ethylthio)-, ethyl ester
CAS No:18224-54-9
MF:C9H16O2S2
MW:220.352140426636
CID:95620
PubChem ID:13275257
Update Time:2025-04-18
2-Propenoic acid, 3,3-bis(ethylthio)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid, 3,3-bis(ethylthio)-, ethyl ester
- ethyl 3,3-bis(ethylsulfanyl)prop-2-enoate
- DTXSID70533971
- 18224-54-9
- 3,3-bis(ethylsulfanyl)-acrylic acid ethyl ester
- ethyl 3,3-bis(ethylsulfanyl)acrylate
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- Inchi： 1S/C9H16O2S2/c1-4-11-8(10)7-9(12-5-2)13-6-3/h7H,4-6H2,1-3H3
- InChI Key： ALCZUBTVPGHRAB-UHFFFAOYSA-N
- SMILES： S(CC)/C(=C/C(=O)OCC)/SCC
Computed Properties
- Exact Mass: 220.05917210g/mol
- Monoisotopic Mass: 220.05917210g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 7
- Complexity: 171
- 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: 2.7
- Topological Polar Surface Area: 76.9?2
2-Propenoic acid, 3,3-bis(ethylthio)-, ethyl ester Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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