Cas no 168902-34-9 (4-Methylthiophene-2-carboxylic acid)
168902-34-9 structure
Product Name:4-Methylthiophene-2-carboxylic acid
CAS No:168902-34-9
MF:C6H6O2S
MW:142.175640583038
CID:2663917
Update Time:2023-08-06
4-Methylthiophene-2-carboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 4-Methylthiophene-2-carboxylic acid
- 4-methyl-2-thiophenecarboxylic acid
- 4-Methyl-thiophene-2-carboxylic acid
- 2-Thiophenecarboxylic acid, 4-methyl-
- PubChem9431
- 4-Methyl-2-thenoic acid
- YCIVJGQMXZZPAB-UHFFFAOYSA-N
- 4-methyl-2-thiopene carboxylic acid
- BBL102930
- STL556739
- SBB017915
- 2-Thiophenecarboxylicacid, 4-methyl-
- 4-methyl 2-thiophene carboxylic acid
- 4-methyl thiophene-2
-
- Inchi： 1S/C6H6O2S/c1-4-2-5(6(7)8)9-3-4/h2-3H,1H3,(H,7,8)
- InChI Key： YCIVJGQMXZZPAB-UHFFFAOYSA-N
- SMILES： S1C=C(C)C=C1C(=O)O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 124
- Topological Polar Surface Area: 65.5
4-Methylthiophene-2-carboxylic acid Related Literature
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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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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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