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920509-97-3 | Oxazole, 4-ethyl-4,5-dihydro-2-[6-(octyloxy)-2-naphthalenyl]-, (4R)-
CAS No: 920509-97-3 Catalog No: AG006ED2 MDL No:
Product Description
Catalog Number:
AG006ED2
Chemical Name:
Oxazole, 4-ethyl-4,5-dihydro-2-[6-(octyloxy)-2-naphthalenyl]-, (4R)-
CAS Number:
920509-97-3
Molecular Formula:
C23H31NO2
Molecular Weight:
353.4977
IUPAC Name:
(4R)-4-ethyl-2-(6-octoxynaphthalen-2-yl)-4,5-dihydro-1,3-oxazole
InChI:
InChI=1S/C23H31NO2/c1-3-5-6-7-8-9-14-25-22-13-12-18-15-20(11-10-19(18)16-22)23-24-21(4-2)17-26-23/h10-13,15-16,21H,3-9,14,17H2,1-2H3/t21-/m1/s1
InChI Key:
GCXKSOUGRFPVSL-OAQYLSRUSA-N
SMILES:
CCCCCCCCOc1ccc2c(c1)ccc(c2)C1=N[C@@H](CO1)CC
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
353.235g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
353.506g/mol
Monoisotopic Mass:
353.235g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
30.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7
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