2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite

C5H3ClF8O — CID 12600159

IUPAC2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite
SMILESFC(F)C(F)(F)C(F)(F)C(F)(F)COCl
InChIInChI=1S/C5H3ClF8O/c6-15-1-3(9,10)5(13,14)4(11,12)2(7)8/h2H,1H2
InChIKeyQQMQHBBPZJXOQQ-UHFFFAOYSA-N
MW266.51 g/mol
LogP3.33
Rot. Bonds5

About 2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite

2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite (PubChem CID 12600159) has the molecular formula C5H3ClF8O and a molecular weight of 266.51 g/mol. Its IUPAC name is 2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite.

Molecular Properties

Compound Name2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite
PubChem CID12600159
Molecular FormulaC5H3ClF8O
Molecular Weight266.51 g/mol
Exact Mass265.97
IUPAC Name2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite
SMILESFC(F)C(F)(F)C(F)(F)C(F)(F)COCl
InChIInChI=1S/C5H3ClF8O/c6-15-1-3(9,10)5(13,14)4(11,12)2(7)8/h2H,1H2
InChIKeyQQMQHBBPZJXOQQ-UHFFFAOYSA-N
XLogP3.33
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.51
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite?
The IUPAC name of 2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite (CID 12600159) is 2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite.
What is the SMILES notation for 2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite?
The canonical SMILES for 2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite is FC(F)C(F)(F)C(F)(F)C(F)(F)COCl.
What is the InChIKey of 2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite?
The InChIKey is QQMQHBBPZJXOQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3ClF8O/c6-15-1-3(9,10)5(13,14)4(11,12)2(7)8/h2H,1H2.
What are the key properties of 2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite?
2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite has a molecular weight of 266.51 g/mol, XLogP of 3.33, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3,4,4,5,5-octafluoropentyl hypochlorite is sourced from PubChem (CID 12600159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).