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88600-56-0

88600-56-0 | 9,10-Anthracenedione, 1,4,5,8-tetraamino-2,7-diphenoxy-

CAS No: 88600-56-0 Catalog No: AG004AYW MDL No:

Product Description

Catalog Number:
AG004AYW
Chemical Name:
9,10-Anthracenedione, 1,4,5,8-tetraamino-2,7-diphenoxy-
CAS Number:
88600-56-0
Molecular Formula:
C26H20N4O4
Molecular Weight:
452.4614
IUPAC Name:
1,4,5,8-tetraamino-2,7-diphenoxyanthracene-9,10-dione
InChI:
InChI=1S/C26H20N4O4/c27-15-11-17(33-13-7-3-1-4-8-13)23(29)21-19(15)25(31)20-16(28)12-18(24(30)22(20)26(21)32)34-14-9-5-2-6-10-14/h1-12H,27-30H2
InChI Key:
RKTOZJRZKCANSB-UHFFFAOYSA-N
SMILES:
O=C1c2c(N)c(Oc3ccccc3)cc(c2C(=O)c2c1c(N)c(Oc1ccccc1)cc2N)N

Properties

Complexity:
695  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
452.148g/mol
Formal Charge:
0
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
452.47g/mol
Monoisotopic Mass:
452.148g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
157A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  

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