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115664-54-5 | 1-Fluoranthenol, 3-nitro-
CAS No: 115664-54-5 Catalog No: AG000GQ0 MDL No:
Product Description
Catalog Number:
AG000GQ0
Chemical Name:
1-Fluoranthenol, 3-nitro-
CAS Number:
115664-54-5
Molecular Formula:
C16H9NO3
Molecular Weight:
263.2476
IUPAC Name:
3-nitrofluoranthen-1-ol
InChI:
InChI=1S/C16H9NO3/c18-14-8-13(17(19)20)12-7-3-6-10-9-4-1-2-5-11(9)16(14)15(10)12/h1-8,18H
InChI Key:
LFZOEZZSTIDRIS-UHFFFAOYSA-N
SMILES:
Oc1cc([N+](=O)[O-])c2c3c1c1ccccc1c3ccc2
Properties
Complexity:
407
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.058g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.252g/mol
Monoisotopic Mass:
263.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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