Cas no 16339-06-3 (Proline, 1-nitroso-,ethyl ester)
16339-06-3 structure
Product Name:Proline, 1-nitroso-,ethyl ester
CAS No:16339-06-3
MF:C7H12N2O3
MW:172.181781768799
CID:185991
PubChem ID:85988
Update Time:2025-04-19
Proline, 1-nitroso-,ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Proline, 1-nitroso-,ethyl ester
- Proline, 1-nitroso-, ethyl ester (7CI,8CI,9CI)
- ethyl 1-nitrosoprolinate
- NITROSOPROLINEETHYLESTER
- N-NITROSO-L-PROLINEETHYLESTER
- N-nitrosoproline ethyl ester
- N-Nitrosoprolinaethylester [German]
- BRN 0393400
- Ethyl 1-nitroso-2-pyrolidinecarboxylate
- Proline, N-nitroso-, ethyl ester
- ethyl 1-nitrosopyrrolidine-2-carboxylate
- N-Nitrosoprolinaethylester
- 16339-06-3
-
- Inchi: 1S/C7H12N2O3/c1-2-12-7(10)6-4-3-5-9(6)8-11/h6H,2-5H2,1H3
- InChI Key: CPURSCKAPPWVBT-UHFFFAOYSA-N
- SMILES: O(CC)C(C1CCCN1N=O)=O
Computed Properties
- Exact Mass: 172.08486
- Monoisotopic Mass: 172.08479225g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 184
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1
- Topological Polar Surface Area: 59?2
Experimental Properties
- PSA: 58.97
Proline, 1-nitroso-,ethyl ester Related Literature
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Patricia A. A. M. Vaz,Jo?o Rocha,Artur M. S. Silva New J. Chem., 2016,40, 8198-8201
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Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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