Cas no 61371-46-8 (Oxazole, 2-[4-(2-phenylethenyl)phenyl]-)
61371-46-8 structure
Product Name:Oxazole, 2-[4-(2-phenylethenyl)phenyl]-
CAS No:61371-46-8
MF:C17H13NO
MW:247.291224241257
CID:481810
PubChem ID:71396399
Update Time:2025-04-19
Oxazole, 2-[4-(2-phenylethenyl)phenyl]- Chemical and Physical Properties
Names and Identifiers
-
- Oxazole, 2-[4-(2-phenylethenyl)phenyl]-
- 2-[4-(2-phenylethenyl)phenyl]-1,3-oxazole
- SCHEMBL22468797
- DTXSID50817968
- 61371-46-8
-
- Inchi: 1S/C17H13NO/c1-2-4-14(5-3-1)6-7-15-8-10-16(11-9-15)17-18-12-13-19-17/h1-13H
- InChI Key: JMTDRVAHTGFRDP-UHFFFAOYSA-N
- SMILES: O1C=CN=C1C1C=CC(C=CC2C=CC=CC=2)=CC=1
Computed Properties
- Exact Mass: 247.09979
- Monoisotopic Mass: 247.099714038g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 288
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 4.3
- Topological Polar Surface Area: 26?2
Experimental Properties
- PSA: 26.03
Oxazole, 2-[4-(2-phenylethenyl)phenyl]- Related Literature
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
-
David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
-
Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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