(E)-3-fluorohex-3-ene

C6H11F — CID 12756890

IUPAC(E)-3-fluorohex-3-ene
SMILESCC/C=C(/F)CC
InChIInChI=1S/C6H11F/c1-3-5-6(7)4-2/h5H,3-4H2,1-2H3/b6-5+
InChIKeyIMSKCQSWQHRTGF-AATRIKPKSA-N
MW102.15 g/mol
LogP2.66
Rot. Bonds2

About (E)-3-fluorohex-3-ene

(E)-3-fluorohex-3-ene (PubChem CID 12756890) has the molecular formula C6H11F and a molecular weight of 102.15 g/mol. Its IUPAC name is (E)-3-fluorohex-3-ene.

Molecular Properties

Compound Name(E)-3-fluorohex-3-ene
PubChem CID12756890
Molecular FormulaC6H11F
Molecular Weight102.15 g/mol
Exact Mass102.08
IUPAC Name(E)-3-fluorohex-3-ene
SMILESCC/C=C(/F)CC
InChIInChI=1S/C6H11F/c1-3-5-6(7)4-2/h5H,3-4H2,1-2H3/b6-5+
InChIKeyIMSKCQSWQHRTGF-AATRIKPKSA-N
XLogP2.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.15
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (E)-3-fluorohex-3-ene?
The IUPAC name of (E)-3-fluorohex-3-ene (CID 12756890) is (E)-3-fluorohex-3-ene.
What is the SMILES notation for (E)-3-fluorohex-3-ene?
The canonical SMILES for (E)-3-fluorohex-3-ene is CC/C=C(/F)CC.
What is the InChIKey of (E)-3-fluorohex-3-ene?
The InChIKey is IMSKCQSWQHRTGF-AATRIKPKSA-N. The full InChI is InChI=1S/C6H11F/c1-3-5-6(7)4-2/h5H,3-4H2,1-2H3/b6-5+.
What are the key properties of (E)-3-fluorohex-3-ene?
(E)-3-fluorohex-3-ene has a molecular weight of 102.15 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-fluorohex-3-ene is sourced from PubChem (CID 12756890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).