5-phenacyloxy-2H-isoquinolin-1-one


Chemical Name: 5-phenacyloxy-2H-isoquinolin-1-one
CAS Number: 1048371-03-4
Product Number: AG008TKG(AGN-PC-04VTEC)
Synonyms:
MDL No: MFCD14051631
Molecular Formula: C17H13NO3
Molecular Weight: 279.2900

Identification/Properties


Computed Properties
Molecular Weight:
279.295g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
279.09g/mol
Monoisotopic Mass:
279.09g/mol
Topological Polar Surface Area:
55.4A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
426
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback