[(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane

C14H26FOP — CID 59878778

IUPAC[(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane
SMILESCCCC/C=C\C[C@H]1C(OP)CC(F)[C@@H]1CC
InChIInChI=1S/C14H26FOP/c1-3-5-6-7-8-9-12-11(4-2)13(15)10-14(12)16-17/h7-8,11-14H,3-6,9-10,17H2,1-2H3/b8-7-/t11-,12-,13?,14?/m1/s1
InChIKeyIQGIJDDCSXVDCE-NGINIPEUSA-N
MW260.33 g/mol
LogP4.68
Rot. Bonds7

About [(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane

[(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane (PubChem CID 59878778) has the molecular formula C14H26FOP and a molecular weight of 260.33 g/mol. Its IUPAC name is [(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane.

Molecular Properties

Compound Name[(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane
PubChem CID59878778
Molecular FormulaC14H26FOP
Molecular Weight260.33 g/mol
Exact Mass260.17
IUPAC Name[(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane
SMILESCCCC/C=C\C[C@H]1C(OP)CC(F)[C@@H]1CC
InChIInChI=1S/C14H26FOP/c1-3-5-6-7-8-9-12-11(4-2)13(15)10-14(12)16-17/h7-8,11-14H,3-6,9-10,17H2,1-2H3/b8-7-/t11-,12-,13?,14?/m1/s1
InChIKeyIQGIJDDCSXVDCE-NGINIPEUSA-N
XLogP4.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.33
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

(1S,2R,3R,4S)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentan-1-ol
CID 59065313
[(1S,2R)-5-fluoro-2-[(Z)-hept-2-enyl]-3-phosphanyloxycyclopentyl]methanol
CID 59878786
[(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-3-enyl]cyclopentyl]oxyphosphane
CID 59878798
[(1S,2R)-5-fluoro-2-[(Z)-hept-3-enyl]-3-phosphanyloxycyclopentyl]methanol
CID 59878800
(1S,2R,3R,4S)-3-ethyl-4-fluoro-2-[(Z)-hept-3-enyl]cyclopentan-1-ol
CID 59878819
3-ethyl-4-fluoro-2-[(E)-hept-2-enyl]cyclopentan-1-ol
CID 22951128
3-ethyl-4-fluoro-2-[(E)-hept-3-enyl]cyclopentan-1-ol
CID 22951130
[5-fluoro-2-[(E)-hept-2-enyl]-3-phosphanyloxycyclopentyl]methanol
CID 22951149
[5-fluoro-2-[(E)-hept-3-enyl]-3-phosphanyloxycyclopentyl]methanol
CID 22951151

Frequently Asked Questions

What is the IUPAC name of [(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane?
The IUPAC name of [(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane (CID 59878778) is [(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane.
What is the SMILES notation for [(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane?
The canonical SMILES for [(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane is CCCC/C=C\C[C@H]1C(OP)CC(F)[C@@H]1CC.
What is the InChIKey of [(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane?
The InChIKey is IQGIJDDCSXVDCE-NGINIPEUSA-N. The full InChI is InChI=1S/C14H26FOP/c1-3-5-6-7-8-9-12-11(4-2)13(15)10-14(12)16-17/h7-8,11-14H,3-6,9-10,17H2,1-2H3/b8-7-/t11-,12-,13?,14?/m1/s1.
What are the key properties of [(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane?
[(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane has a molecular weight of 260.33 g/mol, XLogP of 4.68, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3R)-3-ethyl-4-fluoro-2-[(Z)-hept-2-enyl]cyclopentyl]oxyphosphane is sourced from PubChem (CID 59878778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).