1-(1-fluoroethenoxy)pentane

C7H13FO — CID 88916266

IUPAC1-(1-fluoroethenoxy)pentane
SMILESC=C(F)OCCCCC
InChIInChI=1S/C7H13FO/c1-3-4-5-6-9-7(2)8/h2-6H2,1H3
InChIKeyMIVXCMOFBNENAG-UHFFFAOYSA-N
MW132.18 g/mol
LogP2.63
Rot. Bonds5

About 1-(1-fluoroethenoxy)pentane

1-(1-fluoroethenoxy)pentane (PubChem CID 88916266) has the molecular formula C7H13FO and a molecular weight of 132.18 g/mol. Its IUPAC name is 1-(1-fluoroethenoxy)pentane.

Molecular Properties

Compound Name1-(1-fluoroethenoxy)pentane
PubChem CID88916266
Molecular FormulaC7H13FO
Molecular Weight132.18 g/mol
Exact Mass132.10
IUPAC Name1-(1-fluoroethenoxy)pentane
SMILESC=C(F)OCCCCC
InChIInChI=1S/C7H13FO/c1-3-4-5-6-9-7(2)8/h2-6H2,1H3
InChIKeyMIVXCMOFBNENAG-UHFFFAOYSA-N
XLogP2.63
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.18
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(Ethenyloxy)pentane
CID 21459
1-Fluoro-5-methoxypentane
CID 9770
4-Fluoro-1-methoxypentane
CID 154716146
1-Ethenoxy-2,2,3,3-tetrafluoropentane
CID 20793126
1-(1-Fluoroethenoxy)propane
CID 22996827
1-(Fluoromethoxy)pentane
CID 59049879
1-(1,2,2-Trifluoroethenoxy)pentane
CID 87064004
1-Ethenoxy-1-fluorobutane
CID 87185743
2-Fluoro-1-methoxypentane
CID 87921998
1-[(E)-2-fluoroethenoxy]butane
CID 121431751
1-[(Z)-2-fluoroethenoxy]butane
CID 132064362
1-Fluoro-1-methoxypentane
CID 138657313

Frequently Asked Questions

What is the IUPAC name of 1-(1-fluoroethenoxy)pentane?
The IUPAC name of 1-(1-fluoroethenoxy)pentane (CID 88916266) is 1-(1-fluoroethenoxy)pentane.
What is the SMILES notation for 1-(1-fluoroethenoxy)pentane?
The canonical SMILES for 1-(1-fluoroethenoxy)pentane is C=C(F)OCCCCC.
What is the InChIKey of 1-(1-fluoroethenoxy)pentane?
The InChIKey is MIVXCMOFBNENAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13FO/c1-3-4-5-6-9-7(2)8/h2-6H2,1H3.
What are the key properties of 1-(1-fluoroethenoxy)pentane?
1-(1-fluoroethenoxy)pentane has a molecular weight of 132.18 g/mol, XLogP of 2.63, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-fluoroethenoxy)pentane is sourced from PubChem (CID 88916266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).