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162441-61-4 | 9,10-Anthracenedione, 1,5-bis(ethylamino)-
CAS No: 162441-61-4 Catalog No: AG001T5Y MDL No:
Product Description
Catalog Number:
AG001T5Y
Chemical Name:
9,10-Anthracenedione, 1,5-bis(ethylamino)-
CAS Number:
162441-61-4
Molecular Formula:
C18H18N2O2
Molecular Weight:
294.3477
IUPAC Name:
1,5-bis(ethylamino)anthracene-9,10-dione
InChI:
InChI=1S/C18H18N2O2/c1-3-19-13-9-5-7-11-15(13)17(21)12-8-6-10-14(20-4-2)16(12)18(11)22/h5-10,19-20H,3-4H2,1-2H3
InChI Key:
PZXBRPVCGMJSLE-UHFFFAOYSA-N
SMILES:
CCNc1cccc2c1C(=O)c1c(C2=O)c(NCC)ccc1
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.137g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
294.354g/mol
Monoisotopic Mass:
294.137g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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