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828267-65-8 | 2-Pyrrolidinone, 1-(2,3-dihydro-1-oxo-1H-benz[e]inden-3-yl)-
CAS No: 828267-65-8 Catalog No: AG004XKW MDL No:
Product Description
Catalog Number:
AG004XKW
Chemical Name:
2-Pyrrolidinone, 1-(2,3-dihydro-1-oxo-1H-benz[e]inden-3-yl)-
CAS Number:
828267-65-8
Molecular Formula:
C17H15NO2
Molecular Weight:
265.3065
IUPAC Name:
1-(1-oxo-2,3-dihydrocyclopenta[a]naphthalen-3-yl)pyrrolidin-2-one
InChI:
InChI=1S/C17H15NO2/c19-15-10-14(18-9-3-6-16(18)20)13-8-7-11-4-1-2-5-12(11)17(13)15/h1-2,4-5,7-8,14H,3,6,9-10H2
InChI Key:
KSANLOSJBYLZTR-UHFFFAOYSA-N
SMILES:
O=C1CCCN1C1CC(=O)c2c1ccc1c2cccc1
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.11g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.312g/mol
Monoisotopic Mass:
265.11g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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