pentan-2-yl hypofluorite

C5H11FO — CID 59645033

IUPACpentan-2-yl hypofluorite
SMILESCCCC(C)OF
InChIInChI=1S/C5H11FO/c1-3-4-5(2)7-6/h5H,3-4H2,1-2H3
InChIKeyQGKNXFXTBIMMBN-UHFFFAOYSA-N
MW106.14 g/mol
LogP2.08
Rot. Bonds3

About pentan-2-yl hypofluorite

pentan-2-yl hypofluorite (PubChem CID 59645033) has the molecular formula C5H11FO and a molecular weight of 106.14 g/mol. Its IUPAC name is pentan-2-yl hypofluorite.

Molecular Properties

Compound Namepentan-2-yl hypofluorite
PubChem CID59645033
Molecular FormulaC5H11FO
Molecular Weight106.14 g/mol
Exact Mass106.08
IUPAC Namepentan-2-yl hypofluorite
SMILESCCCC(C)OF
InChIInChI=1S/C5H11FO/c1-3-4-5(2)7-6/h5H,3-4H2,1-2H3
InChIKeyQGKNXFXTBIMMBN-UHFFFAOYSA-N
XLogP2.08
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.14
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-Methoxypentane
CID 522287
3-Methoxypentane
CID 37545
Sodium 3-pentoxide
CID 23676382
Lithium 1-ethylpropoxide
CID 23664307
Potassium hexan-3-olate
CID 135074148
Pentyl hypofluorite
CID 18672972
3-(Fluoromethoxy)hexane
CID 18724441
Sodium pentan-2-olate
CID 18916455
Butan-2-yl hypofluorite
CID 20725353
2-(1-Fluoroethoxy)pentane
CID 57792968
Trifluoro(pentan-2-yloxy)silane
CID 87456365
Pentan-3-yl hypofluorite
CID 87770463

Frequently Asked Questions

What is the IUPAC name of pentan-2-yl hypofluorite?
The IUPAC name of pentan-2-yl hypofluorite (CID 59645033) is pentan-2-yl hypofluorite.
What is the SMILES notation for pentan-2-yl hypofluorite?
The canonical SMILES for pentan-2-yl hypofluorite is CCCC(C)OF.
What is the InChIKey of pentan-2-yl hypofluorite?
The InChIKey is QGKNXFXTBIMMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11FO/c1-3-4-5(2)7-6/h5H,3-4H2,1-2H3.
What are the key properties of pentan-2-yl hypofluorite?
pentan-2-yl hypofluorite has a molecular weight of 106.14 g/mol, XLogP of 2.08, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for pentan-2-yl hypofluorite is sourced from PubChem (CID 59645033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).