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72391-95-8 | 4-nitrofluoren-9-one
CAS No: 72391-95-8 Catalog No: AG005HT4 MDL No:
Product Description
Catalog Number:
AG005HT4
Chemical Name:
4-nitrofluoren-9-one
CAS Number:
72391-95-8
Molecular Formula:
C13H7NO3
Molecular Weight:
225.1996
IUPAC Name:
4-nitrofluoren-9-one
InChI:
InChI=1S/C13H7NO3/c15-13-9-5-2-1-4-8(9)12-10(13)6-3-7-11(12)14(16)17/h1-7H
InChI Key:
CAVWKDDIVRHSEI-UHFFFAOYSA-N
SMILES:
O=C1c2ccccc2c2c1cccc2[N+](=O)[O-]
NSC Number:
116762
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.043g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.203g/mol
Monoisotopic Mass:
225.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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