(Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene

C4H3ClF4 — CID 10261404

IUPAC(Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene
SMILESF/C(=C\CCl)C(F)(F)F
InChIInChI=1S/C4H3ClF4/c5-2-1-3(6)4(7,8)9/h1H,2H2/b3-1-
InChIKeyBSLFLUIZWJXQQU-IWQZZHSRSA-N
MW162.51 g/mol
LogP2.64
Rot. Bonds1

About (Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene

(Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene (PubChem CID 10261404) has the molecular formula C4H3ClF4 and a molecular weight of 162.51 g/mol. Its IUPAC name is (Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene.

Molecular Properties

Compound Name(Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene
PubChem CID10261404
Molecular FormulaC4H3ClF4
Molecular Weight162.51 g/mol
Exact Mass161.99
IUPAC Name(Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene
SMILESF/C(=C\CCl)C(F)(F)F
InChIInChI=1S/C4H3ClF4/c5-2-1-3(6)4(7,8)9/h1H,2H2/b3-1-
InChIKeyBSLFLUIZWJXQQU-IWQZZHSRSA-N
XLogP2.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.51
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene?
The IUPAC name of (Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene (CID 10261404) is (Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene.
What is the SMILES notation for (Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene?
The canonical SMILES for (Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene is F/C(=C\CCl)C(F)(F)F.
What is the InChIKey of (Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene?
The InChIKey is BSLFLUIZWJXQQU-IWQZZHSRSA-N. The full InChI is InChI=1S/C4H3ClF4/c5-2-1-3(6)4(7,8)9/h1H,2H2/b3-1-.
What are the key properties of (Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene?
(Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene has a molecular weight of 162.51 g/mol, XLogP of 2.64, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-chloro-1,1,1,2-tetrafluorobut-2-ene is sourced from PubChem (CID 10261404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).