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88601-71-2 | 9,10-Anthracenedione, 1,4,5,8-tetraamino-2,7-bis(2-methoxyethoxy)-
CAS No: 88601-71-2 Catalog No: AG004CJ9 MDL No:
Product Description
Catalog Number:
AG004CJ9
Chemical Name:
9,10-Anthracenedione, 1,4,5,8-tetraamino-2,7-bis(2-methoxyethoxy)-
CAS Number:
88601-71-2
Molecular Formula:
C20H24N4O6
Molecular Weight:
416.4278
IUPAC Name:
1,4,5,8-tetraamino-2,7-bis(2-methoxyethoxy)anthracene-9,10-dione
InChI:
InChI=1S/C20H24N4O6/c1-27-3-5-29-11-7-9(21)13-15(17(11)23)20(26)16-14(19(13)25)10(22)8-12(18(16)24)30-6-4-28-2/h7-8H,3-6,21-24H2,1-2H3
InChI Key:
QNDIGCPIHQFWOA-UHFFFAOYSA-N
SMILES:
COCCOc1cc(N)c2c(c1N)C(=O)c1c(C2=O)c(N)cc(c1N)OCCOC
Properties
Complexity:
574
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
416.17g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
416.434g/mol
Monoisotopic Mass:
416.17g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
175A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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