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10146-54-0 | 9,10-Anthracenedione, 1,5-diamino-2-methyl-
CAS No: 10146-54-0 Catalog No: AG0004J5 MDL No:
Product Description
Catalog Number:
AG0004J5
Chemical Name:
9,10-Anthracenedione, 1,5-diamino-2-methyl-
CAS Number:
10146-54-0
Molecular Formula:
C15H12N2O2
Molecular Weight:
252.2680
IUPAC Name:
1,5-diamino-2-methylanthracene-9,10-dione
InChI:
InChI=1S/C15H12N2O2/c1-7-5-6-9-12(13(7)17)15(19)8-3-2-4-10(16)11(8)14(9)18/h2-6H,16-17H2,1H3
InChI Key:
LTVYYBIBBCUYAJ-UHFFFAOYSA-N
SMILES:
Nc1c(C)ccc2c1C(=O)c1c(C2=O)c(N)ccc1
Properties
Complexity:
409
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.09g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
252.273g/mol
Monoisotopic Mass:
252.09g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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