Cas no 20461-95-4 (Acetic acid,2,2-bis(ethylthio)-, ethyl ester)
20461-95-4 structure
Product Name:Acetic acid,2,2-bis(ethylthio)-, ethyl ester
CAS No:20461-95-4
MF:C8H16O2S2
MW:208.341440200806
CID:272956
PubChem ID:88550
Update Time:2025-04-19
Acetic acid,2,2-bis(ethylthio)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid,2,2-bis(ethylthio)-, ethyl ester
- ethyl 2,2-bis(ethylsulfanyl)acetate
- Bis-aethylmercapto-essigsaeure-aethylester
- bis-ethylsulfanyl-acetic acid ethyl ester
- ethyl glyoxylate diethyl thioacetal
- Glyoxylic acid ethyl ester diethyl mercaptal
- 5CND477VD7
- DGQHHBMWVOYSHU-UHFFFAOYSA-
- UNII-5CND477VD7
- Ethyl bis(ethylthio)acetate
- ethyl 2, 2-bis(ethylsulfanyl)acetate
- A814581
- Ethyl-bis(ethythio)acetate
- Acetic acid, bis(ethylthio)-, ethyl ester
- ethyl 2,2-bis(ethylthio)acetate
- FT-0638001
- AKOS015915783
- Ethyl di(ethylthio)acetate
- 2,2-bis(ethylthio)acetic acid ethyl ester
- DTXSID30174425
- NS00050995
- J-013339
- 20461-95-4
- DGQHHBMWVOYSHU-UHFFFAOYSA-N
- ethyl 2,2-bis(ethylsulfanyl)ethanoate
- Acetic acid, 2,2-bis(ethylthio)-, ethyl ester
- InChI=1/C8H16O2S2/c1-4-10-7(9)8(11-5-2)12-6-3/h8H,4-6H2,1-3H3
- EINECS 243-836-3
- SCHEMBL11493884
- Ethyl bis(ethylsulfanyl)acetate #
-
- Inchi： 1S/C8H16O2S2/c1-4-10-7(9)8(11-5-2)12-6-3/h8H,4-6H2,1-3H3
- InChI Key： DGQHHBMWVOYSHU-UHFFFAOYSA-N
- SMILES： S(CC)C(C(=O)OCC)SCC
Computed Properties
- Exact Mass: 208.05900
- Monoisotopic Mass: 208.059
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 7
- Complexity: 122
- 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: 2.7
- Topological Polar Surface Area: 76.9A^2
Experimental Properties
- Color/Form: Foul smelling light yellow transparent liquid
- Density: 1.071?g/mL?at 25?°C(lit.)
- Boiling Point: 70?°C0.1?mm Hg(lit.)
- Flash Point: 77?°F
- Refractive Index: n20/D 1.497(lit.)
- PSA: 76.90000
- LogP: 2.38180
- Solubility: Not determined
Acetic acid,2,2-bis(ethylthio)-, ethyl ester Security Information
- Hazardous Material transportation number：UN 3272 3/PG 3
- WGK Germany：3
- Hazard Category Code： 10-36/37/38
- Safety Instruction： S26; S36
- FLUKA BRAND F CODES：13
-
Hazardous Material Identification：
- HazardClass：3.2
- PackingGroup：III
- Safety Term：3.2
- Packing Group：III
- Risk Phrases：R10; R36/37/38
- Packing Group：III
- Hazard Level：3.2
- Storage Condition：Flammable area
Acetic acid,2,2-bis(ethylthio)-, ethyl ester Customs Data
- HS CODE：2930909090
- Customs Data：
China Customs Code:
2930909090Overview:
2930909090. Other organic sulfur compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%
Declaration elements:
Product Name, component content, use to
Summary:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
Acetic acid,2,2-bis(ethylthio)-, ethyl ester Related Literature
-
Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Hailing Chen,Lu Yin,Meng Liu,Laibing Wang,Michiya Fujiki,Wei Zhang RSC Adv., 2019,9, 4849-4856
-
Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
-
Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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