2-chloro-3,4,4,5-tetrafluoropent-1-ene

C5H5ClF4 — CID 87404009

IUPAC2-chloro-3,4,4,5-tetrafluoropent-1-ene
SMILESC=C(Cl)C(F)C(F)(F)CF
InChIInChI=1S/C5H5ClF4/c1-3(6)4(8)5(9,10)2-7/h4H,1-2H2
InChIKeyFNRWLXHHZVEWGC-UHFFFAOYSA-N
MW176.54 g/mol
LogP2.68
Rot. Bonds3

About 2-chloro-3,4,4,5-tetrafluoropent-1-ene

2-chloro-3,4,4,5-tetrafluoropent-1-ene (PubChem CID 87404009) has the molecular formula C5H5ClF4 and a molecular weight of 176.54 g/mol. Its IUPAC name is 2-chloro-3,4,4,5-tetrafluoropent-1-ene.

Molecular Properties

Compound Name2-chloro-3,4,4,5-tetrafluoropent-1-ene
PubChem CID87404009
Molecular FormulaC5H5ClF4
Molecular Weight176.54 g/mol
Exact Mass176.00
IUPAC Name2-chloro-3,4,4,5-tetrafluoropent-1-ene
SMILESC=C(Cl)C(F)C(F)(F)CF
InChIInChI=1S/C5H5ClF4/c1-3(6)4(8)5(9,10)2-7/h4H,1-2H2
InChIKeyFNRWLXHHZVEWGC-UHFFFAOYSA-N
XLogP2.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.54
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-3,4,4,5-tetrafluoropent-1-ene?
The IUPAC name of 2-chloro-3,4,4,5-tetrafluoropent-1-ene (CID 87404009) is 2-chloro-3,4,4,5-tetrafluoropent-1-ene.
What is the SMILES notation for 2-chloro-3,4,4,5-tetrafluoropent-1-ene?
The canonical SMILES for 2-chloro-3,4,4,5-tetrafluoropent-1-ene is C=C(Cl)C(F)C(F)(F)CF.
What is the InChIKey of 2-chloro-3,4,4,5-tetrafluoropent-1-ene?
The InChIKey is FNRWLXHHZVEWGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5ClF4/c1-3(6)4(8)5(9,10)2-7/h4H,1-2H2.
What are the key properties of 2-chloro-3,4,4,5-tetrafluoropent-1-ene?
2-chloro-3,4,4,5-tetrafluoropent-1-ene has a molecular weight of 176.54 g/mol, XLogP of 2.68, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-3,4,4,5-tetrafluoropent-1-ene is sourced from PubChem (CID 87404009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).