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115664-59-0 | 8-Fluoranthenol, 4-nitro-
CAS No: 115664-59-0 Catalog No: AG000GPV MDL No:
Product Description
Catalog Number:
AG000GPV
Chemical Name:
8-Fluoranthenol, 4-nitro-
CAS Number:
115664-59-0
Molecular Formula:
C16H9NO3
Molecular Weight:
263.2476
IUPAC Name:
4-nitrofluoranthen-8-ol
InChI:
InChI=1S/C16H9NO3/c18-9-4-5-10-11-2-1-3-13-15(17(19)20)7-6-12(16(11)13)14(10)8-9/h1-8,18H
InChI Key:
VTHBPJUVHANJGL-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)c1ccc(c3c1c2ccc3)[N+](=O)[O-]
UNII:
R9P173965K
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:
4.4
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