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20662-89-9 | Oxazole, 4-phenyl-
CAS No: 20662-89-9 Catalog No: AG002ILG MDL No:MFCD11845045
Product Description
Catalog Number:
AG002ILG
Chemical Name:
Oxazole, 4-phenyl-
CAS Number:
20662-89-9
Molecular Formula:
C9H7NO
Molecular Weight:
145.1580
MDL Number:
MFCD11845045
IUPAC Name:
4-phenyl-1,3-oxazole
InChI:
InChI=1S/C9H7NO/c1-2-4-8(5-3-1)9-6-11-7-10-9/h1-7H
InChI Key:
NTFMLYSGIKHECT-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1cocn1
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.053g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.161g/mol
Monoisotopic Mass:
145.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| Synthesis of novel pentafluorosulfanylfurans. Two retro-Diels-Alder approaches. | Organic letters 20061123 |
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