Mrv1652303102016502D          

 14 16  0  0  0  0            999 V2000
    7.8614   -7.2313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8614   -8.0563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1468   -6.8188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1468   -8.4688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4323   -7.2313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4323   -8.0563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6459   -6.9764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1309   -7.6438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6461   -8.3113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9815   -6.2228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8020   -6.1366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9513   -7.5576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2868   -6.8040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1073   -6.7178    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  1  2  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  1  1  0  0  0  0
  2  1  1  0  0  0  0
  9  2  1  0  0  0  0
  9  8  1  0  0  0  0
 10  7  1  0  0  0  0
  8  7  2  0  0  0  0
 11 10  2  0  0  0  0
 12  8  1  0  0  0  0
 13 11  1  0  0  0  0
 13 12  2  0  0  0  0
 14 13  1  0  0  0  0
M  END
> <DATABASE_ID>
FDB029318

> <DATABASE_NAME>
foodb

> <SMILES>
OC1=CC2=C(C=C1)C1=CC=CC=C1C2

> <INCHI_IDENTIFIER>
InChI=1S/C13H10O/c14-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8,14H,7H2

> <INCHI_KEY>
ZDOIAPGLORMKTR-UHFFFAOYSA-N

> <FORMULA>
C13H10O

> <MOLECULAR_WEIGHT>
182.2179

> <EXACT_MASS>
182.073164942

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_ATOM_COUNT>
24

> <JCHEM_AVERAGE_POLARIZABILITY>
20.417019573568474

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
9H-fluoren-2-ol

> <ALOGPS_LOGP>
3.45

> <JCHEM_LOGP>
3.4354540673333336

> <ALOGPS_LOGS>
-3.56

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
18.029402726085067

> <JCHEM_PKA_STRONGEST_ACIDIC>
9.921013730302176

> <JCHEM_PKA_STRONGEST_BASIC>
-5.486169706248561

> <JCHEM_POLAR_SURFACE_AREA>
20.23

> <JCHEM_REFRACTIVITY>
56.8543

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
5.00e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
2-hydroxyfluorene

> <JCHEM_VEBER_RULE>
1

> <FOODB_ID>
FDB029318

> <GENERIC_NAME>
2-Hydroxyfluorene

$$$$