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55700-35-1 | 3',4'-Dihydro-3-hydroxy-2'-methyl-7',8'-dimethoxyspiro[2H-indene-2,1'(2'H)-isoquinolin]-1(3H)-one
CAS No: 55700-35-1 Catalog No: AG00DUD8 MDL No:
Product Description
Catalog Number:
AG00DUD8
Chemical Name:
3',4'-Dihydro-3-hydroxy-2'-methyl-7',8'-dimethoxyspiro[2H-indene-2,1'(2'H)-isoquinolin]-1(3H)-one
CAS Number:
55700-35-1
IUPAC Name:
3'-hydroxy-7,8-dimethoxy-2-methylspiro[3,4-dihydroisoquinoline-1,2'-3H-indene]-1'-one
InChI:
InChI=1S/C20H21NO4/c1-21-11-10-12-8-9-15(24-2)17(25-3)16(12)20(21)18(22)13-6-4-5-7-14(13)19(20)23/h4-9,18,22H,10-11H2,1-3H3
InChI Key:
JRCASSLNILYVNJ-UHFFFAOYSA-N
Properties
Complexity:
526
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.147g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
339.391g/mol
Monoisotopic Mass:
339.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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