(E)-1-fluorobut-1-ene

C4H7F — CID 12756872

IUPAC(E)-1-fluorobut-1-ene
SMILESCC/C=C/F
InChIInChI=1S/C4H7F/c1-2-3-4-5/h3-4H,2H2,1H3/b4-3+
InChIKeyWFOIWBGKCSYBJN-ONEGZZNKSA-N
MW74.10 g/mol
LogP1.88
Rot. Bonds1

About (E)-1-fluorobut-1-ene

(E)-1-fluorobut-1-ene (PubChem CID 12756872) has the molecular formula C4H7F and a molecular weight of 74.10 g/mol. Its IUPAC name is (E)-1-fluorobut-1-ene.

Molecular Properties

Compound Name(E)-1-fluorobut-1-ene
PubChem CID12756872
Molecular FormulaC4H7F
Molecular Weight74.10 g/mol
Exact Mass74.05
IUPAC Name(E)-1-fluorobut-1-ene
SMILESCC/C=C/F
InChIInChI=1S/C4H7F/c1-2-3-4-5/h3-4H,2H2,1H3/b4-3+
InChIKeyWFOIWBGKCSYBJN-ONEGZZNKSA-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

Analyze (E)-1-fluorobut-1-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,4,4-Trifluoro-1-butene
CID 10887850
2-Fluoro-1-butene
CID 12756871
1-Pentene, 5-fluoro-
CID 67891
4-Fluoro-1-butene
CID 20234353
1,1,2-Trifluoropenta-1,4-diene
CID 272689
3-Fluoro-1-butene
CID 10952622
3,3-Difluorobut-1-ene
CID 14123435
1-Fluoro-2-cyclobutene
CID 11018801
3-Fluorohex-1-ene
CID 23437622
Fluorobutene
CID 53929488
Fluorohexene
CID 57359528
cis-1-Fluoro-1-hexene
CID 87950676

Frequently Asked Questions

What is the IUPAC name of (E)-1-fluorobut-1-ene?
The IUPAC name of (E)-1-fluorobut-1-ene (CID 12756872) is (E)-1-fluorobut-1-ene.
What is the SMILES notation for (E)-1-fluorobut-1-ene?
The canonical SMILES for (E)-1-fluorobut-1-ene is CC/C=C/F.
What is the InChIKey of (E)-1-fluorobut-1-ene?
The InChIKey is WFOIWBGKCSYBJN-ONEGZZNKSA-N. The full InChI is InChI=1S/C4H7F/c1-2-3-4-5/h3-4H,2H2,1H3/b4-3+.
What are the key properties of (E)-1-fluorobut-1-ene?
(E)-1-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 (E)-1-fluorobut-1-ene is sourced from PubChem (CID 12756872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).