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211426-58-3 | Oxazole, 4,5-dihydro-4,4-dimethyl-2-(9-phenanthrenyl)-
CAS No: 211426-58-3 Catalog No: AG006Z3R MDL No:
Product Description
Catalog Number:
AG006Z3R
Chemical Name:
Oxazole, 4,5-dihydro-4,4-dimethyl-2-(9-phenanthrenyl)-
CAS Number:
211426-58-3
Molecular Formula:
C19H17NO
Molecular Weight:
275.3444
IUPAC Name:
4,4-dimethyl-2-phenanthren-9-yl-5H-1,3-oxazole
InChI:
InChI=1S/C19H17NO/c1-19(2)12-21-18(20-19)17-11-13-7-3-4-8-14(13)15-9-5-6-10-16(15)17/h3-11H,12H2,1-2H3
InChI Key:
BRBTXCQFEZWLBJ-UHFFFAOYSA-N
SMILES:
CC1(C)COC(=N1)c1cc2ccccc2c2c1cccc2
Properties
Complexity:
427
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.131g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.351g/mol
Monoisotopic Mass:
275.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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