(E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene

C4H3F5O — CID 10176261

IUPAC(E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene
SMILESCO/C(F)=C(\F)C(F)(F)F
InChIInChI=1S/C4H3F5O/c1-10-3(6)2(5)4(7,8)9/h1H3/b3-2-
InChIKeyVXXIQFSGULMIQE-IHWYPQMZSA-N
MW162.06 g/mol
LogP2.30
Rot. Bonds1

About (E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene

(E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene (PubChem CID 10176261) has the molecular formula C4H3F5O and a molecular weight of 162.06 g/mol. Its IUPAC name is (E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene.

Molecular Properties

Compound Name(E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene
PubChem CID10176261
Molecular FormulaC4H3F5O
Molecular Weight162.06 g/mol
Exact Mass162.01
IUPAC Name(E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene
SMILESCO/C(F)=C(\F)C(F)(F)F
InChIInChI=1S/C4H3F5O/c1-10-3(6)2(5)4(7,8)9/h1H3/b3-2-
InChIKeyVXXIQFSGULMIQE-IHWYPQMZSA-N
XLogP2.30
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.06
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene?
The IUPAC name of (E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene (CID 10176261) is (E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene.
What is the SMILES notation for (E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene?
The canonical SMILES for (E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene is CO/C(F)=C(\F)C(F)(F)F.
What is the InChIKey of (E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene?
The InChIKey is VXXIQFSGULMIQE-IHWYPQMZSA-N. The full InChI is InChI=1S/C4H3F5O/c1-10-3(6)2(5)4(7,8)9/h1H3/b3-2-.
What are the key properties of (E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene?
(E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene has a molecular weight of 162.06 g/mol, XLogP of 2.30, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1,2,3,3,3-pentafluoro-1-methoxyprop-1-ene is sourced from PubChem (CID 10176261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).