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114608-60-5

114608-60-5 | 9,10-Anthracenedione, 1-(methylamino)-4-[(3-propylphenyl)amino]-

CAS No: 114608-60-5 Catalog No: AG000ETA MDL No:

Product Description

Catalog Number:
AG000ETA
Chemical Name:
9,10-Anthracenedione, 1-(methylamino)-4-[(3-propylphenyl)amino]-
CAS Number:
114608-60-5
Molecular Formula:
C24H22N2O2
Molecular Weight:
370.4437
IUPAC Name:
1-(methylamino)-4-(3-propylanilino)anthracene-9,10-dione
InChI:
InChI=1S/C24H22N2O2/c1-3-7-15-8-6-9-16(14-15)26-20-13-12-19(25-2)21-22(20)24(28)18-11-5-4-10-17(18)23(21)27/h4-6,8-14,25-26H,3,7H2,1-2H3
InChI Key:
LBQOMFISWBJNPW-UHFFFAOYSA-N
SMILES:
CCCc1cccc(c1)Nc1ccc(c2c1C(=O)c1ccccc1C2=O)NC

Properties

Complexity:
577  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.168g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
370.452g/mol
Monoisotopic Mass:
370.168g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.8  

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