(Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene

C8H11ClF4 — CID 142059049

IUPAC(Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene
SMILESCCC(C)C/C(Cl)=C(/F)C(F)(F)F
InChIInChI=1S/C8H11ClF4/c1-3-5(2)4-6(9)7(10)8(11,12)13/h5H,3-4H2,1-2H3/b7-6-
InChIKeyGZFWWCMNTQYFBD-SREVYHEPSA-N
MW218.62 g/mol
LogP4.40
Rot. Bonds3

About (Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene

(Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene (PubChem CID 142059049) has the molecular formula C8H11ClF4 and a molecular weight of 218.62 g/mol. Its IUPAC name is (Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene.

Molecular Properties

Compound Name(Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene
PubChem CID142059049
Molecular FormulaC8H11ClF4
Molecular Weight218.62 g/mol
Exact Mass218.05
IUPAC Name(Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene
SMILESCCC(C)C/C(Cl)=C(/F)C(F)(F)F
InChIInChI=1S/C8H11ClF4/c1-3-5(2)4-6(9)7(10)8(11,12)13/h5H,3-4H2,1-2H3/b7-6-
InChIKeyGZFWWCMNTQYFBD-SREVYHEPSA-N
XLogP4.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.62
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene?
The IUPAC name of (Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene (CID 142059049) is (Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene.
What is the SMILES notation for (Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene?
The canonical SMILES for (Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene is CCC(C)C/C(Cl)=C(/F)C(F)(F)F.
What is the InChIKey of (Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene?
The InChIKey is GZFWWCMNTQYFBD-SREVYHEPSA-N. The full InChI is InChI=1S/C8H11ClF4/c1-3-5(2)4-6(9)7(10)8(11,12)13/h5H,3-4H2,1-2H3/b7-6-.
What are the key properties of (Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene?
(Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene has a molecular weight of 218.62 g/mol, XLogP of 4.40, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-chloro-1,1,1,2-tetrafluoro-5-methylhept-2-ene is sourced from PubChem (CID 142059049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).