2-fluorobut-1-ene

C4H7F — CID 12756871

IUPAC2-fluorobut-1-ene
SMILESC=C(F)CC
InChIInChI=1S/C4H7F/c1-3-4(2)5/h2-3H2,1H3
InChIKeyMRZVFPZZWWSATG-UHFFFAOYSA-N
MW74.10 g/mol
LogP1.88
Rot. Bonds1

About 2-fluorobut-1-ene

2-fluorobut-1-ene (PubChem CID 12756871) has the molecular formula C4H7F and a molecular weight of 74.10 g/mol. Its IUPAC name is 2-fluorobut-1-ene.

Molecular Properties

Compound Name2-fluorobut-1-ene
PubChem CID12756871
Molecular FormulaC4H7F
Molecular Weight74.10 g/mol
Exact Mass74.05
IUPAC Name2-fluorobut-1-ene
SMILESC=C(F)CC
InChIInChI=1S/C4H7F/c1-3-4(2)5/h2-3H2,1H3
InChIKeyMRZVFPZZWWSATG-UHFFFAOYSA-N
XLogP1.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50074.10
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-fluorobut-1-ene?
The IUPAC name of 2-fluorobut-1-ene (CID 12756871) is 2-fluorobut-1-ene.
What is the SMILES notation for 2-fluorobut-1-ene?
The canonical SMILES for 2-fluorobut-1-ene is C=C(F)CC.
What is the InChIKey of 2-fluorobut-1-ene?
The InChIKey is MRZVFPZZWWSATG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7F/c1-3-4(2)5/h2-3H2,1H3.
What are the key properties of 2-fluorobut-1-ene?
2-fluorobut-1-ene has a molecular weight of 74.10 g/mol, XLogP of 1.88, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluorobut-1-ene is sourced from PubChem (CID 12756871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).