Mrv1572004191602092D          

 24 29  0  0  0  0            999 V2000
    5.9448    1.8788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7466    1.0780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7926    1.4212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3503    2.4508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9540    0.8492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5945    2.2220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1982    0.8492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3963    3.2517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1890    3.4805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1890    0.5059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9816    0.7347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9632    2.7941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5761    3.1373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5669    1.1924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1982    2.4508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5945    1.0780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5576    2.2220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3595    1.4212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7834    2.9085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1705    2.5653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1797    1.5356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9724    1.7644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7926    1.8788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5853    2.1076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  2  0  0  0  0
  7  3  1  0  0  0  0
  9  8  2  0  0  0  0
 11 10  2  0  0  0  0
 15  6  1  0  0  0  0
 15  8  1  0  0  0  0
 16  7  2  0  0  0  0
 16 10  1  0  0  0  0
 17  4  2  0  0  0  0
 17 12  1  0  0  0  0
 18  5  2  0  0  0  0
 18 14  1  0  0  0  0
 18 17  1  0  0  0  0
 19  9  1  0  0  0  0
 19 13  2  0  0  0  0
 20 12  2  0  0  0  0
 20 13  1  0  0  0  0
 21 11  1  0  0  0  0
 22 14  2  0  0  0  0
 22 20  1  0  0  0  0
 22 21  1  0  0  0  0
 23 15  2  0  0  0  0
 23 16  1  0  0  0  0
 24 19  1  0  0  0  0
 24 21  2  0  0  0  0
 24 23  1  0  0  0  0
M  END
> <DATABASE_ID>
CHEM007926

> <DATABASE_NAME>
chemdb

> <SMILES>
C1=CC=C2C=C3C(=CC2=C1)C=C1C=CC2=C4C(C=CC3=C14)=CC=C2

> <INCHI_IDENTIFIER>
InChI=1S/C24H14/c1-2-5-18-14-22-20(12-17(18)4-1)13-19-9-8-15-6-3-7-16-10-11-21(22)24(19)23(15)16/h1-14H

> <INCHI_KEY>
AXSJLZJXXUBRBS-UHFFFAOYSA-N

> <FORMULA>
C24H14

> <MOLECULAR_WEIGHT>
302.376

> <EXACT_MASS>
302.109550451

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
38

> <JCHEM_AVERAGE_POLARIZABILITY>
35.57800566278792

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
hexacyclo[14.6.2.0²,¹¹.0⁴,⁹.0¹³,²³.0²⁰,²⁴]tetracosa-1(23),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene

> <ALOGPS_LOGP>
7.50

> <JCHEM_LOGP>
6.2628809940000005

> <ALOGPS_LOGS>
-8.94

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
6

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
99.62299999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.49e-07 g/l

> <JCHEM_TRADITIONAL_IUPAC>
hexacyclo[14.6.2.0²,¹¹.0⁴,⁹.0¹³,²³.0²⁰,²⁴]tetracosa-1(23),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene

> <JCHEM_VEBER_RULE>
1

> <NAME>
Naphtho(2,3-a)pyrene

> <CAS>
196-42-9

> <SYNONYMS>
Perfluoro-4-methylmorpholine

$$$$