(E)-3-chloro-1-fluorohex-3-ene

C6H10ClF — CID 135183238

IUPAC(E)-3-chloro-1-fluorohex-3-ene
SMILESCC/C=C(/Cl)CCF
InChIInChI=1S/C6H10ClF/c1-2-3-6(7)4-5-8/h3H,2,4-5H2,1H3/b6-3+
InChIKeyFCNSLYONZYCXMH-ZZXKWVIFSA-N
MW136.60 g/mol
LogP2.88
Rot. Bonds3

About (E)-3-chloro-1-fluorohex-3-ene

(E)-3-chloro-1-fluorohex-3-ene (PubChem CID 135183238) has the molecular formula C6H10ClF and a molecular weight of 136.60 g/mol. Its IUPAC name is (E)-3-chloro-1-fluorohex-3-ene.

Molecular Properties

Compound Name(E)-3-chloro-1-fluorohex-3-ene
PubChem CID135183238
Molecular FormulaC6H10ClF
Molecular Weight136.60 g/mol
Exact Mass136.05
IUPAC Name(E)-3-chloro-1-fluorohex-3-ene
SMILESCC/C=C(/Cl)CCF
InChIInChI=1S/C6H10ClF/c1-2-3-6(7)4-5-8/h3H,2,4-5H2,1H3/b6-3+
InChIKeyFCNSLYONZYCXMH-ZZXKWVIFSA-N
XLogP2.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.60
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (E)-3-chloro-1-fluorohex-3-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

(Z)-3-Chloro-2-pentene
CID 12705708
2-Chloro-2-pentene
CID 5463222
(E)-2-chloro-pent-2-ene
CID 5463223
cis-3-Chloro-3-hexene
CID 5462940
(E)-3-Chloro-3-hexene
CID 12550105
3-Chloro-2-pentene
CID 54072147
3-Hexene, 3-chloro-
CID 519371
4-Chloro-hept-3-ene
CID 21572682
Chloro-methyl butene
CID 142578
(Z)-3-Chlorhex-2-en
CID 12734570
(e)-3-Chloro-2-hexene
CID 88589144
(E)-3-chloro-4-fluorohex-3-ene
CID 12545942

Frequently Asked Questions

What is the IUPAC name of (E)-3-chloro-1-fluorohex-3-ene?
The IUPAC name of (E)-3-chloro-1-fluorohex-3-ene (CID 135183238) is (E)-3-chloro-1-fluorohex-3-ene.
What is the SMILES notation for (E)-3-chloro-1-fluorohex-3-ene?
The canonical SMILES for (E)-3-chloro-1-fluorohex-3-ene is CC/C=C(/Cl)CCF.
What is the InChIKey of (E)-3-chloro-1-fluorohex-3-ene?
The InChIKey is FCNSLYONZYCXMH-ZZXKWVIFSA-N. The full InChI is InChI=1S/C6H10ClF/c1-2-3-6(7)4-5-8/h3H,2,4-5H2,1H3/b6-3+.
What are the key properties of (E)-3-chloro-1-fluorohex-3-ene?
(E)-3-chloro-1-fluorohex-3-ene has a molecular weight of 136.60 g/mol, XLogP of 2.88, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-chloro-1-fluorohex-3-ene is sourced from PubChem (CID 135183238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).