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2944-27-6 | 9,10-Anthracenedione, 1,5-bis(phenylamino)-
CAS No: 2944-27-6 Catalog No: AG002YE0 MDL No:
Product Description
Catalog Number:
AG002YE0
Chemical Name:
9,10-Anthracenedione, 1,5-bis(phenylamino)-
CAS Number:
2944-27-6
Molecular Formula:
C26H18N2O2
Molecular Weight:
390.4333
IUPAC Name:
1,5-dianilinoanthracene-9,10-dione
InChI:
InChI=1S/C26H18N2O2/c29-25-20-14-8-16-22(28-18-11-5-2-6-12-18)24(20)26(30)19-13-7-15-21(23(19)25)27-17-9-3-1-4-10-17/h1-16,27-28H
InChI Key:
VMDUEJVMKSOQEZ-UHFFFAOYSA-N
SMILES:
O=C1c2cccc(c2C(=O)c2c1c(ccc2)Nc1ccccc1)Nc1ccccc1
Properties
Complexity:
569
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
390.137g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
390.442g/mol
Monoisotopic Mass:
390.137g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.1
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