Cas no 668987-22-2 (1H-Pyrrole-2-carboxylicacid,2-hydroxyethylester(9CI))
668987-22-2 structure
Product Name:1H-Pyrrole-2-carboxylicacid,2-hydroxyethylester(9CI)
CAS No:668987-22-2
MF:C7H9NO3
MW:155.151262044907
CID:1017818
PubChem ID:45082121
Update Time:2025-04-20
1H-Pyrrole-2-carboxylicacid,2-hydroxyethylester(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrrole-2-carboxylicacid,2-hydroxyethylester(9CI)
- 2-hydroxyethyl 1H-pyrrole-2-carboxylate
- DTXSID80665111
- SCHEMBL1170832
- 668987-22-2
-
- Inchi： 1S/C7H9NO3/c9-4-5-11-7(10)6-2-1-3-8-6/h1-3,8-9H,4-5H2
- InChI Key： MPWUTCPIYWRGDI-UHFFFAOYSA-N
- SMILES： O(C(C1=CC=CN1)=O)CCO
Computed Properties
- Exact Mass: 155.058243149g/mol
- Monoisotopic Mass: 155.058243149g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 4
- Complexity: 138
- 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: 0.5
- Topological Polar Surface Area: 62.3?2
1H-Pyrrole-2-carboxylicacid,2-hydroxyethylester(9CI) Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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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
668987-22-2 (1H-Pyrrole-2-carboxylicacid,2-hydroxyethylester(9CI)) Related Products
- 1194-97-4(5-Methyl-2-(methoxycarbonyl)pyrrole)
- 21908-10-1(Ethyl 6-Formylpyridine-2-carboxylate)
- 39640-51-2(Ethyl 6-methylpyridine-2-carboxylate)
- 15658-60-3(Diethyl 2,6-pyridinedicarboxylate)
- 2199-43-1(Ethyl 1H-pyrrole-2-carboxylate)
- 1193-62-0(Methyl 1H-pyrrole-2-carboxylate)
- 41337-81-9(Ethyl 6-(hydroxymethyl)pyridine-2-carboxylate)
- 2459-07-6(methyl pyridine-2-carboxylate)
- 2524-52-9(Ethyl picolinate)
- 21855-16-3(6-(ethoxycarbonyl)pyridine-2-carboxylic acid)
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