but-2-ene;hydrofluoride

C4H9F — CID 160556119

IUPACbut-2-ene;hydrofluoride
SMILESCC=CC.F
InChIInChI=1S/C4H8.FH/c1-3-4-2;/h3-4H,1-2H3;1H
InChIKeyOBJMCPZZLJJCNB-UHFFFAOYSA-N
MW76.11 g/mol
LogP1.73
Rot. Bonds

About but-2-ene;hydrofluoride

but-2-ene;hydrofluoride (PubChem CID 160556119) has the molecular formula C4H9F and a molecular weight of 76.11 g/mol. Its IUPAC name is but-2-ene;hydrofluoride.

Molecular Properties

Compound Namebut-2-ene;hydrofluoride
PubChem CID160556119
Molecular FormulaC4H9F
Molecular Weight76.11 g/mol
Exact Mass76.07
IUPAC Namebut-2-ene;hydrofluoride
SMILESCC=CC.F
InChIInChI=1S/C4H8.FH/c1-3-4-2;/h3-4H,1-2H3;1H
InChIKeyOBJMCPZZLJJCNB-UHFFFAOYSA-N
XLogP1.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50076.11
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of but-2-ene;hydrofluoride?
The IUPAC name of but-2-ene;hydrofluoride (CID 160556119) is but-2-ene;hydrofluoride.
What is the SMILES notation for but-2-ene;hydrofluoride?
The canonical SMILES for but-2-ene;hydrofluoride is CC=CC.F.
What is the InChIKey of but-2-ene;hydrofluoride?
The InChIKey is OBJMCPZZLJJCNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8.FH/c1-3-4-2;/h3-4H,1-2H3;1H.
What are the key properties of but-2-ene;hydrofluoride?
but-2-ene;hydrofluoride has a molecular weight of 76.11 g/mol, XLogP of 1.73, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for but-2-ene;hydrofluoride is sourced from PubChem (CID 160556119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).