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87696-46-6 | Oxazole, 5-(5-hexenyloxy)-2-phenyl-
CAS No: 87696-46-6 Catalog No: AG004NIO MDL No:
Product Description
Catalog Number:
AG004NIO
Chemical Name:
Oxazole, 5-(5-hexenyloxy)-2-phenyl-
CAS Number:
87696-46-6
Molecular Formula:
C15H17NO2
Molecular Weight:
243.3010
IUPAC Name:
5-hex-5-enoxy-2-phenyl-1,3-oxazole
InChI:
InChI=1S/C15H17NO2/c1-2-3-4-8-11-17-14-12-16-15(18-14)13-9-6-5-7-10-13/h2,5-7,9-10,12H,1,3-4,8,11H2
InChI Key:
ZAYPPCVPPKKWED-UHFFFAOYSA-N
SMILES:
C=CCCCCOc1cnc(o1)c1ccccc1
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.126g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.306g/mol
Monoisotopic Mass:
243.126g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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