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77508-71-5 | 1-(4,5-Dihydro-3,5-diphenylisoxazol-4-yl)-1-propanone
CAS No: 77508-71-5 Catalog No: AG00GPO8 MDL No:
Product Description
Catalog Number:
AG00GPO8
Chemical Name:
1-(4,5-Dihydro-3,5-diphenylisoxazol-4-yl)-1-propanone
CAS Number:
77508-71-5
IUPAC Name:
1-(3,5-diphenyl-4,5-dihydro-1,2-oxazol-4-yl)propan-1-one
InChI:
InChI=1S/C18H17NO2/c1-2-15(20)16-17(13-9-5-3-6-10-13)19-21-18(16)14-11-7-4-8-12-14/h3-12,16,18H,2H2,1H3
InChI Key:
YHXXSNZNJBUHHG-UHFFFAOYSA-N
Properties
Complexity:
392
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.126g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.339g/mol
Monoisotopic Mass:
279.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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