Cas no 89499-47-8 (2-Thiophenecarboxylic acid, 5-(acetylamino)-, ethyl ester)
89499-47-8 structure
Product Name:2-Thiophenecarboxylic acid, 5-(acetylamino)-, ethyl ester
CAS No:89499-47-8
MF:C9H11NO3S
MW:213.253541231155
CID:598733
PubChem ID:13742235
Update Time:2025-04-19
2-Thiophenecarboxylic acid, 5-(acetylamino)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
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- 2-Thiophenecarboxylic acid, 5-(acetylamino)-, ethyl ester
- ethyl 5-acetamidothiophene-2-carboxylate
- DTXSID70548202
- BWZJBVVCZYGVAK-UHFFFAOYSA-
- InChI=1/C9H11NO3S/c1-3-13-9(12)7-4-5-8(14-7)10-6(2)11/h4-5H,3H2,1-2H3,(H,10,11)
- 89499-47-8
-
- Inchi： 1S/C9H11NO3S/c1-3-13-9(12)7-4-5-8(14-7)10-6(2)11/h4-5H,3H2,1-2H3,(H,10,11)
- InChI Key： BWZJBVVCZYGVAK-UHFFFAOYSA-N
- SMILES： S1C(C(=O)OCC)=CC=C1NC(C)=O
Computed Properties
- Exact Mass: 213.04596439g/mol
- Monoisotopic Mass: 213.04596439g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 232
- 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: 1.7
- Topological Polar Surface Area: 83.6?2
2-Thiophenecarboxylic acid, 5-(acetylamino)-, ethyl ester Related Literature
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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