2,2,3,3-tetrafluoropropyl hypochlorite

C3H3ClF4O — CID 12650399

IUPAC2,2,3,3-tetrafluoropropyl hypochlorite
SMILESFC(F)C(F)(F)COCl
InChIInChI=1S/C3H3ClF4O/c4-9-1-3(7,8)2(5)6/h2H,1H2
InChIKeyWVYNBBCSCKZXHQ-UHFFFAOYSA-N
MW166.50 g/mol
LogP2.06
Rot. Bonds3

About 2,2,3,3-tetrafluoropropyl hypochlorite

2,2,3,3-tetrafluoropropyl hypochlorite (PubChem CID 12650399) has the molecular formula C3H3ClF4O and a molecular weight of 166.50 g/mol. Its IUPAC name is 2,2,3,3-tetrafluoropropyl hypochlorite.

Molecular Properties

Compound Name2,2,3,3-tetrafluoropropyl hypochlorite
PubChem CID12650399
Molecular FormulaC3H3ClF4O
Molecular Weight166.50 g/mol
Exact Mass165.98
IUPAC Name2,2,3,3-tetrafluoropropyl hypochlorite
SMILESFC(F)C(F)(F)COCl
InChIInChI=1S/C3H3ClF4O/c4-9-1-3(7,8)2(5)6/h2H,1H2
InChIKeyWVYNBBCSCKZXHQ-UHFFFAOYSA-N
XLogP2.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.50
LogP ≤ 52.06
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-tetrafluoropropyl hypochlorite?
The IUPAC name of 2,2,3,3-tetrafluoropropyl hypochlorite (CID 12650399) is 2,2,3,3-tetrafluoropropyl hypochlorite.
What is the SMILES notation for 2,2,3,3-tetrafluoropropyl hypochlorite?
The canonical SMILES for 2,2,3,3-tetrafluoropropyl hypochlorite is FC(F)C(F)(F)COCl.
What is the InChIKey of 2,2,3,3-tetrafluoropropyl hypochlorite?
The InChIKey is WVYNBBCSCKZXHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3ClF4O/c4-9-1-3(7,8)2(5)6/h2H,1H2.
What are the key properties of 2,2,3,3-tetrafluoropropyl hypochlorite?
2,2,3,3-tetrafluoropropyl hypochlorite has a molecular weight of 166.50 g/mol, XLogP of 2.06, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetrafluoropropyl hypochlorite is sourced from PubChem (CID 12650399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).