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89023-99-4 | Cyclobut[b]anthracene-4,9-dione, 1,2-dihydro-3,10-dimethoxy-
CAS No: 89023-99-4 Catalog No: AG0044CG MDL No:
Product Description
Catalog Number:
AG0044CG
Chemical Name:
Cyclobut[b]anthracene-4,9-dione, 1,2-dihydro-3,10-dimethoxy-
CAS Number:
89023-99-4
Molecular Formula:
C18H14O4
Molecular Weight:
294.3014
IUPAC Name:
11,16-dimethoxytetracyclo[8.6.0.03,8.012,15]hexadeca-1(16),3,5,7,10,12(15)-hexaene-2,9-dione
InChI:
InChI=1S/C18H14O4/c1-21-17-11-7-8-12(11)18(22-2)14-13(17)15(19)9-5-3-4-6-10(9)16(14)20/h3-6H,7-8H2,1-2H3
InChI Key:
PMNPKXVLZBIBLN-UHFFFAOYSA-N
SMILES:
COc1c2C(=O)c3ccccc3C(=O)c2c(c2c1CC2)OC
Properties
Complexity:
444
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.089g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.306g/mol
Monoisotopic Mass:
294.089g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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