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830925-70-7 | 5H-Benzo[b]carbazole-6,11-dione, 3-ethoxy-5-ethyl-
CAS No: 830925-70-7 Catalog No: AG005C6E MDL No:
Product Description
Catalog Number:
AG005C6E
Chemical Name:
5H-Benzo[b]carbazole-6,11-dione, 3-ethoxy-5-ethyl-
CAS Number:
830925-70-7
Molecular Formula:
C20H17NO3
Molecular Weight:
319.3539
IUPAC Name:
3-ethoxy-5-ethylbenzo[b]carbazole-6,11-dione
InChI:
InChI=1S/C20H17NO3/c1-3-21-16-11-12(24-4-2)9-10-15(16)17-18(21)20(23)14-8-6-5-7-13(14)19(17)22/h5-11H,3-4H2,1-2H3
InChI Key:
NLHWHUALYOFNQL-UHFFFAOYSA-N
SMILES:
CCOc1ccc2c(c1)n(CC)c1c2C(=O)c2c(C1=O)cccc2
Properties
Complexity:
519
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.121g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.36g/mol
Monoisotopic Mass:
319.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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