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31616-64-5 | anthra[1,2-c]benzimidazo[2,1-i]benzo[lmn][2,8]phenanthroline-5,9,20(6H)-trione
CAS No: 31616-64-5 Catalog No: AG00CPM9 MDL No:
Product Description
Catalog Number:
AG00CPM9
Chemical Name:
anthra[1,2-c]benzimidazo[2,1-i]benzo[lmn][2,8]phenanthroline-5,9,20(6H)-trione
CAS Number:
31616-64-5
IUPAC Name:
16,22,29-triazanonacyclo[18.13.2.02,15.05,14.07,12.017,34.022,30.023,28.031,35]pentatriaconta-1(34),2(15),3,5(14),7,9,11,17,19,23,25,27,29,31(35),32-pentadecaene-6,13,21-trione
InChI:
InChI=1S/C32H15N3O3/c36-29-17-5-1-2-6-18(17)30(37)27-19(29)11-10-16-15-9-12-20-25-21(13-14-23(26(15)25)33-28(16)27)32(38)35-24-8-4-3-7-22(24)34-31(20)35/h1-14,33H
InChI Key:
NEFHTDXKDJVQPK-UHFFFAOYSA-N
EC Number:
250-732-1
Properties
Complexity:
1060
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
489.111g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
489.49g/mol
Monoisotopic Mass:
489.111g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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