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56196-57-7 | 1',3',7,8-Tetrahydrospiro[1,3-dioxolo[4,5-g]isoquinoline-5(6H),2'-[2H]indene]-1',3'-diol
CAS No: 56196-57-7 Catalog No: AG00E74J MDL No:
Product Description
Catalog Number:
AG00E74J
Chemical Name:
1',3',7,8-Tetrahydrospiro[1,3-dioxolo[4,5-g]isoquinoline-5(6H),2'-[2H]indene]-1',3'-diol
CAS Number:
56196-57-7
IUPAC Name:
spiro[1,3-dihydroindene-2,5'-7,8-dihydro-6H-[1,3]dioxolo[4,5-g]isoquinoline]-1,3-diol
InChI:
InChI=1S/C18H17NO4/c20-16-11-3-1-2-4-12(11)17(21)18(16)13-8-15-14(22-9-23-15)7-10(13)5-6-19-18/h1-4,7-8,16-17,19-21H,5-6,9H2
InChI Key:
UAYPLGORFOMPNI-UHFFFAOYSA-N
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.116g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
311.337g/mol
Monoisotopic Mass:
311.116g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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