Cas no 61260-45-5 (Oxazole, 4,5-dihydro-4-methyl-2-phenyl-, (S)-)
61260-45-5 structure
Product Name:Oxazole, 4,5-dihydro-4-methyl-2-phenyl-, (S)-
CAS No:61260-45-5
MF:C10H11NO
MW:161.200442552567
CID:486775
PubChem ID:12037931
Update Time:2025-04-19
Oxazole, 4,5-dihydro-4-methyl-2-phenyl-, (S)- Chemical and Physical Properties
Names and Identifiers
-
- Oxazole, 4,5-dihydro-4-methyl-2-phenyl-, (S)-
- (4S)-4-methyl-2-phenyl-4,5-dihydro-1,3-oxazole
- V10356
- 61260-45-5
- DTXSID10476318
- CTK2E3882
- (S)-4-METHYL-2-PHENYL-4,5-DIHYDROOXAZOLE
-
- Inchi： 1S/C10H11NO/c1-8-7-12-10(11-8)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3/t8-/m0/s1
- InChI Key： LDESTFIGYTYDHH-QMMMGPOBSA-N
- SMILES： O1C(C2C=CC=CC=2)=N[C@@H](C)C1
Computed Properties
- Exact Mass: 161.08413
- Monoisotopic Mass: 161.084063974g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 182
- 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
- XLogP3: 1.9
- Topological Polar Surface Area: 21.6?2
Experimental Properties
- PSA: 21.59
Oxazole, 4,5-dihydro-4-methyl-2-phenyl-, (S)- Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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