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827302-98-7 | Oxazole, 5-methyl-2-(1-methylethyl)-4-(2-naphthalenyl)-
CAS No: 827302-98-7 Catalog No: AG0059FS MDL No:
Product Description
Catalog Number:
AG0059FS
Chemical Name:
Oxazole, 5-methyl-2-(1-methylethyl)-4-(2-naphthalenyl)-
CAS Number:
827302-98-7
Molecular Formula:
C17H17NO
Molecular Weight:
251.3230
IUPAC Name:
5-methyl-4-naphthalen-2-yl-2-propan-2-yl-1,3-oxazole
InChI:
InChI=1S/C17H17NO/c1-11(2)17-18-16(12(3)19-17)15-9-8-13-6-4-5-7-14(13)10-15/h4-11H,1-3H3
InChI Key:
YQYZVYTZRIVEAJ-UHFFFAOYSA-N
SMILES:
Cc1oc(nc1c1ccc2c(c1)cccc2)C(C)C
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.131g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.329g/mol
Monoisotopic Mass:
251.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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