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Home > Imidazoles > 1334147-85-1
1334147-85-1 | 4'-methoxy-2',3'-dihydrospiro[imidazolidine-4,1'-indene]-2,5-dione
CAS No: 1334147-85-1 Catalog No: AG01AKIE MDL No:MFCD19982586
Product Description
Catalog Number:
AG01AKIE
Chemical Name:
4'-methoxy-2',3'-dihydrospiro[imidazolidine-4,1'-indene]-2,5-dione
CAS Number:
1334147-85-1
Molecular Formula:
C12H12N2O3
Molecular Weight:
232.2353
MDL Number:
MFCD19982586
IUPAC Name:
7-methoxyspiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione
InChI:
InChI=1S/C12H12N2O3/c1-17-9-4-2-3-8-7(9)5-6-12(8)10(15)13-11(16)14-12/h2-4H,5-6H2,1H3,(H2,13,14,15,16)
InChI Key:
MOSBUFFKERZJQM-UHFFFAOYSA-N
SMILES:
COc1cccc2c1CCC12NC(=O)NC1=O
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.085g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
232.239g/mol
Monoisotopic Mass:
232.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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