Ketcher 10161717242D 1   1.00000     0.00000     0

 17 16  0     0  0            999 V2000
   21.1711   -6.5232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9039   -6.5232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.6364   -6.5232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.0375   -6.0231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.7702   -6.0231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3049   -6.0231    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   21.1711   -7.5235    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   24.6364   -7.5235    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   25.5028   -6.0231    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   20.3085   -7.0145    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   25.5031   -7.0266    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   23.2700   -5.1567    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   24.2704   -5.1567    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   23.4040   -7.3895    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   22.4036   -7.3895    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   21.5373   -5.1567    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   22.5376   -5.1567    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0     0  0
  4  2  1  0     0  0
  2  5  1  0     0  0
  5  3  1  0     0  0
  1  7  1  0     0  0
  3  8  1  0     0  0
  1  6  1  0     0  0
  3  9  1  0     0  0
  1 10  1  0     0  0
  3 11  1  0     0  0
 12  5  1  0     0  0
 13  5  1  0     0  0
 14  2  1  0     0  0
 15  2  1  0     0  0
 16  4  1  0     0  0
 17  4  1  0     0  0
M  END
> <ID>
CHEBI:39428

> <NAME>
perfluoropentane

> <DEFINITION>
A fluorocarbon that is pentane in which all of the hydrogens have been replaced by fluorines.

> <STAR>
3

> <SYNONYM>
perfluoro-n-pentane; NVX-108; n-perfluoropentane

> <IUPAC_NAME>
dodecafluoropentane

> <INN>
perflenapentum; perflenapent; perflenapent; perflenapent

> <FORMULA>
C5F12

> <MASS>
288.035

> <MONOISOTOPIC_MASS>
287.98084

> <CHARGE>
0

> <SMILES>
C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)(F)F

> <INCHI>
InChI=1S/C5F12/c6-1(7,2(8,9)4(12,13)14)3(10,11)5(15,16)17

> <INCHIKEY>
NJCBUSHGCBERSK-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
1712388

> <CAS_REGISTRY_NUMBER>
678-26-2

> <CHEMIDPLUS>
678-26-2

> <KEGG_DRUG_ACCESSION>
D05436

> <NIST_CHEMISTRY_WEBBOOK>
678-26-2

> <WIKIPEDIA_ACCESSION>
Perflenapent

> <PUBMED_CITATION>
20218695; 25007887; 25646576; 26515239; 26794250; 27501802; 28028728; 28184161

$$$$