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

C6H5F7O — CID 14093191

IUPAC(Z)-2,3,3,4,4,5,5-heptafluoro-1-methoxypent-1-ene
SMILESCO/C=C(\F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C6H5F7O/c1-14-2-3(7)5(10,11)6(12,13)4(8)9/h2,4H,1H3/b3-2-
InChIKeyAQKGTZRVCGINNE-IHWYPQMZSA-N
MW226.09 g/mol
LogP2.98
Rot. Bonds4

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

(Z)-2,3,3,4,4,5,5-heptafluoro-1-methoxypent-1-ene (PubChem CID 14093191) has the molecular formula C6H5F7O and a molecular weight of 226.09 g/mol. Its IUPAC name is (Z)-2,3,3,4,4,5,5-heptafluoro-1-methoxypent-1-ene.

Molecular Properties

Compound Name(Z)-2,3,3,4,4,5,5-heptafluoro-1-methoxypent-1-ene
PubChem CID14093191
Molecular FormulaC6H5F7O
Molecular Weight226.09 g/mol
Exact Mass226.02
IUPAC Name(Z)-2,3,3,4,4,5,5-heptafluoro-1-methoxypent-1-ene
SMILESCO/C=C(\F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C6H5F7O/c1-14-2-3(7)5(10,11)6(12,13)4(8)9/h2,4H,1H3/b3-2-
InChIKeyAQKGTZRVCGINNE-IHWYPQMZSA-N
XLogP2.98
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.09
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-2,3,3,4,4,5,5-heptafluoro-1-methoxypent-1-ene?
The IUPAC name of (Z)-2,3,3,4,4,5,5-heptafluoro-1-methoxypent-1-ene (CID 14093191) is (Z)-2,3,3,4,4,5,5-heptafluoro-1-methoxypent-1-ene.
What is the SMILES notation for (Z)-2,3,3,4,4,5,5-heptafluoro-1-methoxypent-1-ene?
The canonical SMILES for (Z)-2,3,3,4,4,5,5-heptafluoro-1-methoxypent-1-ene is CO/C=C(\F)C(F)(F)C(F)(F)C(F)F.
What is the InChIKey of (Z)-2,3,3,4,4,5,5-heptafluoro-1-methoxypent-1-ene?
The InChIKey is AQKGTZRVCGINNE-IHWYPQMZSA-N. The full InChI is InChI=1S/C6H5F7O/c1-14-2-3(7)5(10,11)6(12,13)4(8)9/h2,4H,1H3/b3-2-.
What are the key properties of (Z)-2,3,3,4,4,5,5-heptafluoro-1-methoxypent-1-ene?
(Z)-2,3,3,4,4,5,5-heptafluoro-1-methoxypent-1-ene has a molecular weight of 226.09 g/mol, XLogP of 2.98, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2,3,3,4,4,5,5-heptafluoro-1-methoxypent-1-ene is sourced from PubChem (CID 14093191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).