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144128-99-4

144128-99-4 | 1,9(2H,10H)-Acridinedione, 7-chloro-10-ethyl-3,4-dihydro-3-[4-(trifluoromethyl)phenyl]-

CAS No: 144128-99-4 Catalog No: AG001IZ5 MDL No:

Product Description

Catalog Number:
AG001IZ5
Chemical Name:
1,9(2H,10H)-Acridinedione, 7-chloro-10-ethyl-3,4-dihydro-3-[4-(trifluoromethyl)phenyl]-
CAS Number:
144128-99-4
Molecular Formula:
C22H17ClF3NO2
Molecular Weight:
419.8241
IUPAC Name:
7-chloro-10-ethyl-3-[4-(trifluoromethyl)phenyl]-3,4-dihydro-2H-acridine-1,9-dione
InChI:
InChI=1S/C22H17ClF3NO2/c1-2-27-17-8-7-15(23)11-16(17)21(29)20-18(27)9-13(10-19(20)28)12-3-5-14(6-4-12)22(24,25)26/h3-8,11,13H,2,9-10H2,1H3
InChI Key:
RTRJVHVJPBNBLY-UHFFFAOYSA-N
SMILES:
CCn1c2CC(CC(=O)c2c(=O)c2c1ccc(c2)Cl)c1ccc(cc1)C(F)(F)F

Properties

Complexity:
711  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
419.09g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
419.828g/mol
Monoisotopic Mass:
419.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  

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