butan-2-yl hypofluorite

C4H9FO — CID 20725353

IUPACbutan-2-yl hypofluorite
SMILESCCC(C)OF
InChIInChI=1S/C4H9FO/c1-3-4(2)6-5/h4H,3H2,1-2H3
InChIKeyBAROCYVGNLPWEE-UHFFFAOYSA-N
MW92.11 g/mol
LogP1.69
Rot. Bonds2

About butan-2-yl hypofluorite

butan-2-yl hypofluorite (PubChem CID 20725353) has the molecular formula C4H9FO and a molecular weight of 92.11 g/mol. Its IUPAC name is butan-2-yl hypofluorite.

Molecular Properties

Compound Namebutan-2-yl hypofluorite
PubChem CID20725353
Molecular FormulaC4H9FO
Molecular Weight92.11 g/mol
Exact Mass92.06
IUPAC Namebutan-2-yl hypofluorite
SMILESCCC(C)OF
InChIInChI=1S/C4H9FO/c1-3-4(2)6-5/h4H,3H2,1-2H3
InChIKeyBAROCYVGNLPWEE-UHFFFAOYSA-N
XLogP1.69
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50092.11
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-Methoxypropane
CID 11721
2-Methoxybutane
CID 23238
Isopropyl fluoromethyl ether
CID 21954138
Sodium butan-2-olate
CID 23663649
Lithium sec-butoxide
CID 23689932
Potassium 1-methylpropoxide
CID 23694743
Ethyl-ethanol sulphide
CID 91502732
Dimethylgallium isopropoxide
CID 129868720
Isopropyl methyl-d3-ether
CID 141478
Sec-butoxide
CID 3664836
Propan-2-yl hypofluorite
CID 18679080
1-Fluoro-2-methoxybutane
CID 20783144

Frequently Asked Questions

What is the IUPAC name of butan-2-yl hypofluorite?
The IUPAC name of butan-2-yl hypofluorite (CID 20725353) is butan-2-yl hypofluorite.
What is the SMILES notation for butan-2-yl hypofluorite?
The canonical SMILES for butan-2-yl hypofluorite is CCC(C)OF.
What is the InChIKey of butan-2-yl hypofluorite?
The InChIKey is BAROCYVGNLPWEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9FO/c1-3-4(2)6-5/h4H,3H2,1-2H3.
What are the key properties of butan-2-yl hypofluorite?
butan-2-yl hypofluorite has a molecular weight of 92.11 g/mol, XLogP of 1.69, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butan-2-yl hypofluorite is sourced from PubChem (CID 20725353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).