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72894-22-5 | 6,7-diethoxy-2-(phenylmethyl)-1H-benz[de]isoquinoline-1,3(2H)-dione
CAS No: 72894-22-5 Catalog No: AG00FOGA MDL No:
Product Description
Catalog Number:
AG00FOGA
Chemical Name:
6,7-diethoxy-2-(phenylmethyl)-1H-benz[de]isoquinoline-1,3(2H)-dione
CAS Number:
72894-22-5
IUPAC Name:
2-benzyl-6,7-diethoxybenzo[de]isoquinoline-1,3-dione
InChI:
InChI=1S/C23H21NO4/c1-3-27-18-12-10-16-20-17(11-13-19(21(18)20)28-4-2)23(26)24(22(16)25)14-15-8-6-5-7-9-15/h5-13H,3-4,14H2,1-2H3
InChI Key:
FJHLVFINFGYXGU-UHFFFAOYSA-N
EC Number:
276-971-1
Properties
Complexity:
535
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
375.147g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
375.424g/mol
Monoisotopic Mass:
375.147g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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