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13823-58-0 | 9H-Fluorene-1-carboxylic acid, 7-bromo-9-oxo-
CAS No: 13823-58-0 Catalog No: AG0018D9 MDL No:
Product Description
Catalog Number:
AG0018D9
Chemical Name:
9H-Fluorene-1-carboxylic acid, 7-bromo-9-oxo-
CAS Number:
13823-58-0
Molecular Formula:
C14H7BrO3
Molecular Weight:
303.1076
IUPAC Name:
7-bromo-9-oxofluorene-1-carboxylic acid
InChI:
InChI=1S/C14H7BrO3/c15-7-4-5-8-9-2-1-3-10(14(17)18)12(9)13(16)11(8)6-7/h1-6H,(H,17,18)
InChI Key:
DFWVSSUXZJPXPO-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)C(=O)c1c2cccc1C(=O)O
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.958g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
303.111g/mol
Monoisotopic Mass:
301.958g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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