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122719-42-0 | 2,5-Pyrrolidinedione, 1-(1-anthracenyl)-
CAS No: 122719-42-0 Catalog No: AG000J1K MDL No:
Product Description
Catalog Number:
AG000J1K
Chemical Name:
2,5-Pyrrolidinedione, 1-(1-anthracenyl)-
CAS Number:
122719-42-0
Molecular Formula:
C18H13NO2
Molecular Weight:
275.3013
IUPAC Name:
1-anthracen-1-ylpyrrolidine-2,5-dione
InChI:
InChI=1S/C18H13NO2/c20-17-8-9-18(21)19(17)16-7-3-6-14-10-12-4-1-2-5-13(12)11-15(14)16/h1-7,10-11H,8-9H2
InChI Key:
CLKDWYBWEIMTKF-UHFFFAOYSA-N
SMILES:
O=C1CCC(=O)N1c1cccc2c1cc1ccccc1c2
Properties
Complexity:
431
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.095g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.307g/mol
Monoisotopic Mass:
275.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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