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478029-56-0 | 17-ethoxy-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2(7),3,5,9(14),10,12-hexaene-16,18-dione
CAS No: 478029-56-0 Catalog No: AG01FONP MDL No:
Product Description
Catalog Number:
AG01FONP
Chemical Name:
17-ethoxy-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2(7),3,5,9(14),10,12-hexaene-16,18-dione
CAS Number:
478029-56-0
IUPAC Name:
17-ethoxy-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
InChI:
InChI=1S/C20H17NO3/c1-2-24-21-19(22)17-15-11-7-3-4-8-12(11)16(18(17)20(21)23)14-10-6-5-9-13(14)15/h3-10,15-18H,2H2,1H3
InChI Key:
KLDGHKPBLWSXTD-UHFFFAOYSA-N
Properties
Complexity:
491
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:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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