Cas no 57069-22-4 (2-Oxazolamine, 4-methyl-N-(1-methylethyl)-)
57069-22-4 structure
Product Name:2-Oxazolamine, 4-methyl-N-(1-methylethyl)-
CAS No:57069-22-4
MF:C7H12N2O
MW:140.182981491089
CID:346573
PubChem ID:12295225
Update Time:2025-04-19
2-Oxazolamine, 4-methyl-N-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Oxazolamine, 4-methyl-N-(1-methylethyl)-
- 4-methyl-N-propan-2-yl-1,3-oxazol-2-amine
- SCHEMBL11537597
- DTXSID00485419
- 57069-22-4
- AKOS006356693
-
- Inchi： 1S/C7H12N2O/c1-5(2)8-7-9-6(3)4-10-7/h4-5H,1-3H3,(H,8,9)
- InChI Key： DQCDBEDQHPFGQK-UHFFFAOYSA-N
- SMILES： O1C=C(C)N=C1NC(C)C
Computed Properties
- Exact Mass: 140.09506
- Monoisotopic Mass: 140.094963011g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 106
- 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: 1.9
- Topological Polar Surface Area: 38.1?2
Experimental Properties
- PSA: 38.06
2-Oxazolamine, 4-methyl-N-(1-methylethyl)- Related Literature
-
Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
-
Richa Sardessai,Shobhana Krishnaswamy,Mysore S. Shashidhar CrystEngComm, 2012,14, 8010-8016
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