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13287-72-4 | 9H-Fluoren-9-one, 2-chloro-3-nitro-
CAS No: 13287-72-4 Catalog No: AG0011BI MDL No:
Product Description
Catalog Number:
AG0011BI
Chemical Name:
9H-Fluoren-9-one, 2-chloro-3-nitro-
CAS Number:
13287-72-4
Molecular Formula:
C13H6ClNO3
Molecular Weight:
259.6446
IUPAC Name:
2-chloro-3-nitrofluoren-9-one
InChI:
InChI=1S/C13H6ClNO3/c14-11-5-10-9(6-12(11)15(17)18)7-3-1-2-4-8(7)13(10)16/h1-6H
InChI Key:
RIRJJCJZFSFOHX-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2c3ccccc3C(=O)c2cc1Cl
NSC Number:
88991
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.004g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.645g/mol
Monoisotopic Mass:
259.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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