Cas no 285133-33-7 (5(4H)-Oxazolone,2-(aminomethyl)-4-methyl-, (4S)-)
285133-33-7 structure
Product Name:5(4H)-Oxazolone,2-(aminomethyl)-4-methyl-, (4S)-
CAS No:285133-33-7
MF:C5H8N2O2
MW:128.129220962524
CID:248507
Update Time:2022-07-27
5(4H)-Oxazolone,2-(aminomethyl)-4-methyl-, (4S)- Chemical and Physical Properties
Names and Identifiers
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- 5(4H)-Oxazolone,2-(aminomethyl)-4-methyl-, (4S)-
- 5(4H)-Oxazolone,2-(aminomethyl)-4-methyl-,(4S)-(9CI)
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- Inchi： 1S/C5H8N2O2/c1-3-5(8)9-4(2-6)7-3/h3H,2,6H2,1H3/t3-/m0/s1
- InChI Key： YDGZPLVFUOBXAB-VKHMYHEASA-N
- SMILES： O1C(=O)[C@H](C)N=C1CN
Computed Properties
- Exact Mass: 128.059
- Monoisotopic Mass: 128.059
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 164
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 64.7A^2
5(4H)-Oxazolone,2-(aminomethyl)-4-methyl-, (4S)- Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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