1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane

C5H4Br2Cl2F4 — CID 119097133

IUPAC1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane
SMILESFC(F)(Br)C(F)(F)C(Cl)(Cl)CCBr
InChIInChI=1S/C5H4Br2Cl2F4/c6-2-1-3(8,9)4(10,11)5(7,12)13/h1-2H2
InChIKeyFPNZIAZISWMZHV-UHFFFAOYSA-N
MW370.79 g/mol
LogP4.57
Rot. Bonds4

About 1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane

1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane (PubChem CID 119097133) has the molecular formula C5H4Br2Cl2F4 and a molecular weight of 370.79 g/mol. Its IUPAC name is 1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane.

Molecular Properties

Compound Name1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane
PubChem CID119097133
Molecular FormulaC5H4Br2Cl2F4
Molecular Weight370.79 g/mol
Exact Mass367.80
IUPAC Name1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane
SMILESFC(F)(Br)C(F)(F)C(Cl)(Cl)CCBr
InChIInChI=1S/C5H4Br2Cl2F4/c6-2-1-3(8,9)4(10,11)5(7,12)13/h1-2H2
InChIKeyFPNZIAZISWMZHV-UHFFFAOYSA-N
XLogP4.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.79
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

(2R)-1,4-dibromo-2-chloro-1,1,2-trifluorobutane
CID 86308801
1,1,3-tribromo-1,2,2,3,3-pentafluoropropane
CID 15186175
1-bromo-3,4-dichloro-1,1,2,2,3,4,4-heptafluorobutane
CID 139890181
1,2-dibromo-1,1-dichloro-2,2-difluoroethane
CID 2773960
(2R)-1-bromo-2-chloro-1,1,2-trifluorobutane
CID 95757021
CID 87453461
CID 87453461
1-bromo-1,1,3-trichloro-2,2,3,3-tetrafluoropropane
CID 15921925
1,1,4,4-tetrachloro-1,4-difluorobutane
CID 19764101
1,1-dibromo-1,2,2,2-tetrafluoroethane;ethane
CID 158764810
1-bromo-1-chloro-1-fluoroethane
CID 57450899
5-bromo-1,1,1,2,3,3-hexafluoropentane
CID 154143021
4-chloro-1,1,1,2,2,3,3-heptafluoro-4-methylpentane
CID 154321348

Frequently Asked Questions

What is the IUPAC name of 1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane?
The IUPAC name of 1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane (CID 119097133) is 1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane.
What is the SMILES notation for 1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane?
The canonical SMILES for 1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane is FC(F)(Br)C(F)(F)C(Cl)(Cl)CCBr.
What is the InChIKey of 1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane?
The InChIKey is FPNZIAZISWMZHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4Br2Cl2F4/c6-2-1-3(8,9)4(10,11)5(7,12)13/h1-2H2.
What are the key properties of 1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane?
1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane has a molecular weight of 370.79 g/mol, XLogP of 4.57, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dibromo-3,3-dichloro-1,1,2,2-tetrafluoropentane is sourced from PubChem (CID 119097133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).