1-chloro-5,5,5-trifluoropent-1-ene

C5H6ClF3 — CID 73181128

IUPAC1-chloro-5,5,5-trifluoropent-1-ene
SMILESFC(F)(F)CCC=CCl
InChIInChI=1S/C5H6ClF3/c6-4-2-1-3-5(7,8)9/h2,4H,1,3H2
InChIKeyWJEZATWNARIUDX-UHFFFAOYSA-N
MW158.55 g/mol
LogP3.08
Rot. Bonds2

About 1-chloro-5,5,5-trifluoropent-1-ene

1-chloro-5,5,5-trifluoropent-1-ene (PubChem CID 73181128) has the molecular formula C5H6ClF3 and a molecular weight of 158.55 g/mol. Its IUPAC name is 1-chloro-5,5,5-trifluoropent-1-ene.

Molecular Properties

Compound Name1-chloro-5,5,5-trifluoropent-1-ene
PubChem CID73181128
Molecular FormulaC5H6ClF3
Molecular Weight158.55 g/mol
Exact Mass158.01
IUPAC Name1-chloro-5,5,5-trifluoropent-1-ene
SMILESFC(F)(F)CCC=CCl
InChIInChI=1S/C5H6ClF3/c6-4-2-1-3-5(7,8)9/h2,4H,1,3H2
InChIKeyWJEZATWNARIUDX-UHFFFAOYSA-N
XLogP3.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.55
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-chloro-5,5,5-trifluoropent-1-ene?
The IUPAC name of 1-chloro-5,5,5-trifluoropent-1-ene (CID 73181128) is 1-chloro-5,5,5-trifluoropent-1-ene.
What is the SMILES notation for 1-chloro-5,5,5-trifluoropent-1-ene?
The canonical SMILES for 1-chloro-5,5,5-trifluoropent-1-ene is FC(F)(F)CCC=CCl.
What is the InChIKey of 1-chloro-5,5,5-trifluoropent-1-ene?
The InChIKey is WJEZATWNARIUDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6ClF3/c6-4-2-1-3-5(7,8)9/h2,4H,1,3H2.
What are the key properties of 1-chloro-5,5,5-trifluoropent-1-ene?
1-chloro-5,5,5-trifluoropent-1-ene has a molecular weight of 158.55 g/mol, XLogP of 3.08, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-5,5,5-trifluoropent-1-ene is sourced from PubChem (CID 73181128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).