Cas no 19995-39-2 (Propanedioic acid, methyl[2-(2-thienyl)ethyl]-, diethyl ester)
![Propanedioic acid, methyl[2-(2-thienyl)ethyl]-, diethyl ester structure](https://ossimg.kuujia.com/scimg/20000/19995-39-2x500.png)
19995-39-2 structure
Product Name:Propanedioic acid, methyl[2-(2-thienyl)ethyl]-, diethyl ester
CAS No:19995-39-2
MF:C14H20O4S
MW:284.371203422546
CID:1391003
PubChem ID:85759744
Update Time:2025-04-20
Propanedioic acid, methyl[2-(2-thienyl)ethyl]-, diethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanedioic acid, methyl[2-(2-thienyl)ethyl]-, diethyl ester
- HRKJCZIDJUZTEE-UHFFFAOYSA-N
- 19995-39-2
- DTXSID401182302
- 2-Methyl-2-(2-thienyl)ethylmalonic Acid Diethylester
-
- Inchi： 1S/C14H20O4S/c1-4-17-12(15)14(3,13(16)18-5-2)9-8-11-7-6-10-19-11/h6-7,10H,4-5,8-9H2,1-3H3
- InChI Key： HRKJCZIDJUZTEE-UHFFFAOYSA-N
- SMILES： S1C=CC=C1CCC(C(=O)OCC)(C(=O)OCC)C
Computed Properties
- Exact Mass: 284.10823029g/mol
- Monoisotopic Mass: 284.10823029g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 19
- Rotatable Bond Count: 9
- Complexity: 299
- 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: 3.3
- Topological Polar Surface Area: 80.8?2
Propanedioic acid, methyl[2-(2-thienyl)ethyl]-, diethyl ester Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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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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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
19995-39-2 (Propanedioic acid, methyl[2-(2-thienyl)ethyl]-, diethyl ester) Related Products
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