Cas no 99328-39-9 (4-Oxo-Tetrahydro-Thiophene-3-CarboxylicAcidMethylEster)
99328-39-9 structure
Product Name:4-Oxo-Tetrahydro-Thiophene-3-CarboxylicAcidMethylEster
CAS No:99328-39-9
MF:C6H8O3S
MW:160.190920829773
CID:1002849
PubChem ID:98424
Update Time:2025-04-20
4-Oxo-Tetrahydro-Thiophene-3-CarboxylicAcidMethylEster Chemical and Physical Properties
Names and Identifiers
-
- 4-Oxo-Tetrahydro-Thiophene-3-CarboxylicAcidMethylEster
- 3-Oxo-4-methoxycarbonyltetrahydrothiophene
- 22097-90-1
- 3-carbomethoxytetrahydrothiophene-4-one
- AMY24700
- NS00050045
- STR01903
- Methyl 4-oxotetrahydro-3-thiophenecarboxylate #
- SCHEMBL11051478
- 2689-68-1
- Methyl 4-Oxotetrahydrothiophene-3-carboxylate
- methyl 4-oxo-2,3,4,5-tetrahydrothiophene-3-carboxylate
- Methyl tetrahydro-4-oxo-3-thiophenecarboxylate
- 4-oxotetrahydro-3-thiophencarboxylic acid methyl ester
- 4-OXO-TETRAHYDRO-THIOPHENE-3-CARBOXYLIC ACIDMETHYL ESTER
- EINECS 220-256-9
- Methyl 3-oxotetrahydrothiophene-4-carboxylate
- SDCCGMLS-0066124.P001
- NSC-127560
- Tetrahydrothiophen-3-one-4-carboxylic acid, methyl ester
- methyl-4-oxo-2,3,4,5-tetrahydrothiophene-3-carboxylate
- BB 0218009
- 4-oxotetrahydro thiophene-3-carboxylic acid methyl ester
- NSC 127560
- EN300-105501
- CS-0106054
- FT-0628657
- methyl 3-keto-1,5-dihydrothiophene-4-carboxylate
- AKOS016340868
- 3-Thiophenecarboxylic acid, tetrahydro-4-oxo-, methyl ester
- methyl tetrahydro-4-oxo-3-thiophene carboxylate
- methyl 4-oxothiolane-3-carboxylate
- 4-Carbomethoxy-3-thiophanone
- 4-Carbomethoxytetrahydro-3-thiophenone
- 4-Oxo-tetrahydrothiophene-3-carboxylic acid methyl ester
- methyl-4-oxo-tetrahydro-thiophene-3-carboxylate
- SCHEMBL189981
- Methyl4-oxo-tetrahydrothiophene-3-carboxylate
- methyl 4-oxo-tetrahydrothiophene-3-carboxylate
- AKOS000281333
- methyl tetrahydro-thiophene-3-one-4-carboxylate
- Methyl4-oxotetrahydrothiophene-3-carboxylate
- NSC127560
- methyl tetrahydro-4-oxothiophene-3-carboxylate
- W-202140
- methyl 4-oxo-2,3,5-trihydrothiophene-3-carboxylate
- PS-4377
- 4-Oxo-tetrahydro-thiophene-3-carboxylic acid methyl ester
- 4-oxo-3-methoxycarbonyltetrahydrothiophene
- A5274
- 99328-39-9
- methyl 3-keto-3,4-dihydrothiophene-4-carboxylate
- tetrahydro-4-oxo-3-thiophene carboxylic acid, methyl ester
- MFCD00052381
- 3-oxo-tetrahydrothiophene-4-carboxylic acid methyl ester
- DTXSID40863010
- methyl 4-oxotetrahydro-thiophene-3-carboxylate
- Methyl tetrahydro-4-oxo-3-thenoate
- Methyl 4-oxotetrahydrothiophene-3-carboxylate, tech
- Tetrahydro-4-oxo-3-thiophenecarboxylic acid methyl ester
- SY029389
- DB-015135
-
- Inchi: 1S/C6H8O3S/c1-9-6(8)4-2-10-3-5(4)7/h4H,2-3H2,1H3
- InChI Key: LEAKUJFYXNILRB-UHFFFAOYSA-N
- SMILES: S1CC(C(C(=O)OC)C1)=O
Computed Properties
- Exact Mass: 160.01941529g/mol
- Monoisotopic Mass: 160.01941529g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 166
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.5
- Topological Polar Surface Area: 68.7?2
4-Oxo-Tetrahydro-Thiophene-3-CarboxylicAcidMethylEster Related Literature
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
-
Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
-
Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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