Cas no 1204245-38-4 (1-amino-5-(aminocarbonyl)-1H-Pyrrole-3-carboxylic acid methyl ester)
1204245-38-4 structure
Product Name:1-amino-5-(aminocarbonyl)-1H-Pyrrole-3-carboxylic acid methyl ester
CAS No:1204245-38-4
MF:C7H9N3O3
MW:183.164661169052
CID:1101686
PubChem ID:66985220
Update Time:2025-04-20
1-amino-5-(aminocarbonyl)-1H-Pyrrole-3-carboxylic acid methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1-amino-5-(aminocarbonyl)-1H-Pyrrole-3-carboxylic acid methyl ester
- 1204245-38-4
- DB-084653
- MEQMEGRAIAVPIA-UHFFFAOYSA-N
- Methyl 1-amino-5-carbamoyl-1H-pyrrole-3-carboxylate
- SCHEMBL1299358
-
- Inchi： 1S/C7H9N3O3/c1-13-7(12)4-2-5(6(8)11)10(9)3-4/h2-3H,9H2,1H3,(H2,8,11)
- InChI Key： MEQMEGRAIAVPIA-UHFFFAOYSA-N
- SMILES： O(C)C(C1=CN(C(C(N)=O)=C1)N)=O
Computed Properties
- Exact Mass: 183.06439116g/mol
- Monoisotopic Mass: 183.06439116g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 231
- 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
- Topological Polar Surface Area: 100?2
1-amino-5-(aminocarbonyl)-1H-Pyrrole-3-carboxylic acid methyl ester Related Literature
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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