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1245648-23-0 | Oxazole, 2-(2-ethyl-3-methoxyphenyl)-2,5-dihydro-5,5-dimethyl-
CAS No: 1245648-23-0 Catalog No: AG000MBF MDL No:
Product Description
Catalog Number:
AG000MBF
Chemical Name:
Oxazole, 2-(2-ethyl-3-methoxyphenyl)-2,5-dihydro-5,5-dimethyl-
CAS Number:
1245648-23-0
Molecular Formula:
C14H19NO2
Molecular Weight:
233.3062
IUPAC Name:
2-(2-ethyl-3-methoxyphenyl)-5,5-dimethyl-2H-1,3-oxazole
InChI:
InChI=1S/C14H19NO2/c1-5-10-11(7-6-8-12(10)16-4)13-15-9-14(2,3)17-13/h6-9,13H,5H2,1-4H3
InChI Key:
WSNLIFIEZISZFL-UHFFFAOYSA-N
SMILES:
CCc1c(OC)cccc1C1N=CC(O1)(C)C
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.142g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.311g/mol
Monoisotopic Mass:
233.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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