(E)-3-chloro-4-fluorohex-3-ene

C6H10ClF — CID 12545942

IUPAC(E)-3-chloro-4-fluorohex-3-ene
SMILESCC/C(F)=C(\Cl)CC
InChIInChI=1S/C6H10ClF/c1-3-5(7)6(8)4-2/h3-4H2,1-2H3/b6-5+
InChIKeyZQYBRUBUYGQVMX-AATRIKPKSA-N
MW136.60 g/mol
LogP3.23
Rot. Bonds2

About (E)-3-chloro-4-fluorohex-3-ene

(E)-3-chloro-4-fluorohex-3-ene (PubChem CID 12545942) has the molecular formula C6H10ClF and a molecular weight of 136.60 g/mol. Its IUPAC name is (E)-3-chloro-4-fluorohex-3-ene.

Molecular Properties

Compound Name(E)-3-chloro-4-fluorohex-3-ene
PubChem CID12545942
Molecular FormulaC6H10ClF
Molecular Weight136.60 g/mol
Exact Mass136.05
IUPAC Name(E)-3-chloro-4-fluorohex-3-ene
SMILESCC/C(F)=C(\Cl)CC
InChIInChI=1S/C6H10ClF/c1-3-5(7)6(8)4-2/h3-4H2,1-2H3/b6-5+
InChIKeyZQYBRUBUYGQVMX-AATRIKPKSA-N
XLogP3.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.60
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(3E)-3,4-dichlorohex-3-ene
CID 642202
(Z)-2-chloro-3-fluoro-4-methylpent-2-ene
CID 23384795
(Z)-3-chloro-2-fluoro-4-methylpent-2-ene
CID 23384886
(E)-2-chloro-3-fluoro-4-methylpent-2-ene
CID 59911179
(E)-3-chloro-2-fluoro-4-methylpent-2-ene
CID 59911424
3-Chloro-2-fluoropent-2-ene
CID 123701630
(4E)-2-chloro-4-fluorohexa-1,4-diene
CID 131999813
(E)-3-chloro-1-fluorohex-3-ene
CID 135183238
(Z)-3-chloro-2-fluoropent-2-ene
CID 143343164
(E)-3-chloro-1-fluoropent-2-ene
CID 145213533
(Z)-2-chloro-3-fluoropent-2-ene
CID 154933528
(Z)-3,4-dichlorohex-3-ene
CID 12710507

Frequently Asked Questions

What is the IUPAC name of (E)-3-chloro-4-fluorohex-3-ene?
The IUPAC name of (E)-3-chloro-4-fluorohex-3-ene (CID 12545942) is (E)-3-chloro-4-fluorohex-3-ene.
What is the SMILES notation for (E)-3-chloro-4-fluorohex-3-ene?
The canonical SMILES for (E)-3-chloro-4-fluorohex-3-ene is CC/C(F)=C(\Cl)CC.
What is the InChIKey of (E)-3-chloro-4-fluorohex-3-ene?
The InChIKey is ZQYBRUBUYGQVMX-AATRIKPKSA-N. The full InChI is InChI=1S/C6H10ClF/c1-3-5(7)6(8)4-2/h3-4H2,1-2H3/b6-5+.
What are the key properties of (E)-3-chloro-4-fluorohex-3-ene?
(E)-3-chloro-4-fluorohex-3-ene has a molecular weight of 136.60 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-chloro-4-fluorohex-3-ene is sourced from PubChem (CID 12545942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).