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23613-36-7 | 9H-Fluorene-4-carboxylic acid, 2,7-dinitro-9-oxo-
CAS No: 23613-36-7 Catalog No: AG002NWD MDL No:MFCD00180013
Product Description
Catalog Number:
AG002NWD
Chemical Name:
9H-Fluorene-4-carboxylic acid, 2,7-dinitro-9-oxo-
CAS Number:
23613-36-7
Molecular Formula:
C14H6N2O7
Molecular Weight:
314.2066
MDL Number:
MFCD00180013
IUPAC Name:
2,7-dinitro-9-oxofluorene-4-carboxylic acid
InChI:
InChI=1S/C14H6N2O7/c17-13-9-3-6(15(20)21)1-2-8(9)12-10(13)4-7(16(22)23)5-11(12)14(18)19/h1-5H,(H,18,19)
InChI Key:
OVLRXSIUWAOXBL-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(cc2c1c1ccc(cc1C2=O)[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
567
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.018g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.209g/mol
Monoisotopic Mass:
314.018g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
146A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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