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1175-56-0 | Fluoren-9-one, 4-iodo-2,5,7-trinitro-, compd. with benzene (1:1) (8CI)
CAS No: 1175-56-0 Catalog No: AG000EDH MDL No:
Product Description
Catalog Number:
AG000EDH
Chemical Name:
Fluoren-9-one, 4-iodo-2,5,7-trinitro-, compd. with benzene (1:1) (8CI)
CAS Number:
1175-56-0
IUPAC Name:
benzene;4-iodo-2,5,7-trinitrofluoren-9-one
InChI:
InChI=1S/C13H4IN3O7.C6H6/c14-9-3-5(15(19)20)1-7-11(9)12-8(13(7)18)2-6(16(21)22)4-10(12)17(23)24;1-2-4-6-5-3-1/h1-4H;1-6H
InChI Key:
DGIYLTHWEQIOEU-UHFFFAOYSA-N
NSC Number:
97622
Properties
Complexity:
613
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
518.956g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
519.207g/mol
Monoisotopic Mass:
518.956g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
155A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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