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139584-05-7 | Acridinone
CAS No: 139584-05-7 Catalog No: AG001BBH MDL No:
Product Description
Catalog Number:
AG001BBH
Chemical Name:
Acridinone
CAS Number:
139584-05-7
Molecular Formula:
C13H9NO
Molecular Weight:
195.2167
IUPAC Name:
2H-acridin-1-one
InChI:
InChI=1S/C13H9NO/c15-13-7-3-6-12-10(13)8-9-4-1-2-5-11(9)14-12/h1-6,8H,7H2
InChI Key:
IPFDTWHBEBJTLE-UHFFFAOYSA-N
SMILES:
O=C1CC=Cc2c1cc1ccccc1n2
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.068g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.221g/mol
Monoisotopic Mass:
195.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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