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110866-68-7 | Oxazole, 4,5-dihydro-2-[4-([1,1'-biphenyl]-4-yloxy)butyl]-
CAS No: 110866-68-7 Catalog No: AG007C23 MDL No:
Product Description
Catalog Number:
AG007C23
Chemical Name:
Oxazole, 4,5-dihydro-2-[4-([1,1'-biphenyl]-4-yloxy)butyl]-
CAS Number:
110866-68-7
Molecular Formula:
C19H21NO2
Molecular Weight:
295.3755
IUPAC Name:
2-[4-(4-phenylphenoxy)butyl]-4,5-dihydro-1,3-oxazole
InChI:
InChI=1S/C19H21NO2/c1-2-6-16(7-3-1)17-9-11-18(12-10-17)21-14-5-4-8-19-20-13-15-22-19/h1-3,6-7,9-12H,4-5,8,13-15H2
InChI Key:
ZDNPOAPBZXTPOI-UHFFFAOYSA-N
SMILES:
C(COc1ccc(cc1)c1ccccc1)CCC1=NCCO1
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.157g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.382g/mol
Monoisotopic Mass:
295.157g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
30.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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