(Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene

C6H3F9O — CID 146451149

IUPAC(Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene
SMILESCOC(F)(/C(F)=C(/F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H3F9O/c1-16-4(9,6(13,14)15)2(7)3(8)5(10,11)12/h1H3/b3-2-
InChIKeyRXTHCRMIJMEURB-IHWYPQMZSA-N
MW262.07 g/mol
LogP3.57
Rot. Bonds2

About (Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene

(Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene (PubChem CID 146451149) has the molecular formula C6H3F9O and a molecular weight of 262.07 g/mol. Its IUPAC name is (Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene.

Molecular Properties

Compound Name(Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene
PubChem CID146451149
Molecular FormulaC6H3F9O
Molecular Weight262.07 g/mol
Exact Mass262.00
IUPAC Name(Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene
SMILESCOC(F)(/C(F)=C(/F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H3F9O/c1-16-4(9,6(13,14)15)2(7)3(8)5(10,11)12/h1H3/b3-2-
InChIKeyRXTHCRMIJMEURB-IHWYPQMZSA-N
XLogP3.57
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.07
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene?
The IUPAC name of (Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene (CID 146451149) is (Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene.
What is the SMILES notation for (Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene?
The canonical SMILES for (Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene is COC(F)(/C(F)=C(/F)C(F)(F)F)C(F)(F)F.
What is the InChIKey of (Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene?
The InChIKey is RXTHCRMIJMEURB-IHWYPQMZSA-N. The full InChI is InChI=1S/C6H3F9O/c1-16-4(9,6(13,14)15)2(7)3(8)5(10,11)12/h1H3/b3-2-.
What are the key properties of (Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene?
(Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene has a molecular weight of 262.07 g/mol, XLogP of 3.57, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene is sourced from PubChem (CID 146451149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).