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19871-57-9

19871-57-9 | 9,10-Anthracenedione, 1,4-bis[(3-aminopropyl)amino]-5,8-dihydroxy-

CAS No: 19871-57-9 Catalog No: AG002BPJ MDL No:

Product Description

Catalog Number:
AG002BPJ
Chemical Name:
9,10-Anthracenedione, 1,4-bis[(3-aminopropyl)amino]-5,8-dihydroxy-
CAS Number:
19871-57-9
Molecular Formula:
C20H24N4O4
Molecular Weight:
384.4290
IUPAC Name:
1,4-bis(3-aminopropylamino)-5,8-dihydroxyanthracene-9,10-dione
InChI:
InChI=1S/C20H24N4O4/c21-7-1-9-23-11-3-4-12(24-10-2-8-22)16-15(11)19(27)17-13(25)5-6-14(26)18(17)20(16)28/h3-6,23-26H,1-2,7-10,21-22H2
InChI Key:
BDYRCLTVDLUGLN-UHFFFAOYSA-N
SMILES:
NCCCNc1ccc(c2c1C(=O)c1c(C2=O)c(O)ccc1O)NCCCN

Properties

Complexity:
512  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.18g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
384.436g/mol
Monoisotopic Mass:
384.18g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
151A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

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