1-fluoro-9-prop-1-en-2-yloxynonane

C12H23FO — CID 176669375

IUPAC1-fluoro-9-prop-1-en-2-yloxynonane
SMILESC=C(C)OCCCCCCCCCF
InChIInChI=1S/C12H23FO/c1-12(2)14-11-9-7-5-3-4-6-8-10-13/h1,3-11H2,2H3
InChIKeyJYLMMMWLWPFOGE-UHFFFAOYSA-N
MW202.31 g/mol
LogP4.24
Rot. Bonds10

About 1-fluoro-9-prop-1-en-2-yloxynonane

1-fluoro-9-prop-1-en-2-yloxynonane (PubChem CID 176669375) has the molecular formula C12H23FO and a molecular weight of 202.31 g/mol. Its IUPAC name is 1-fluoro-9-prop-1-en-2-yloxynonane.

Molecular Properties

Compound Name1-fluoro-9-prop-1-en-2-yloxynonane
PubChem CID176669375
Molecular FormulaC12H23FO
Molecular Weight202.31 g/mol
Exact Mass202.17
IUPAC Name1-fluoro-9-prop-1-en-2-yloxynonane
SMILESC=C(C)OCCCCCCCCCF
InChIInChI=1S/C12H23FO/c1-12(2)14-11-9-7-5-3-4-6-8-10-13/h1,3-11H2,2H3
InChIKeyJYLMMMWLWPFOGE-UHFFFAOYSA-N
XLogP4.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.31
LogP ≤ 54.24
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-[(E)-2-fluoroethenoxy]dodecane
CID 121408637
n-Octyloxyallene
CID 11052055
2-Ethoxynon-1-ene
CID 12385679
1-Prop-1-en-2-yloxyhexane
CID 20071898
Isopropenyl octadecyl ether
CID 22407739
1-[(Prop-1-en-2-yl)oxy]dodecane
CID 71365772
n-Octyl-pentaoxyethylene
CID 129682506
3-fluoro-2-[(E)-prop-1-enoxy]decane
CID 18972205
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluoro-10-prop-1-en-2-yloxydecane
CID 53784079
3-Fluoro-2-prop-1-enoxydecane
CID 73473902
4-Ethoxy-4-fluorotridecane
CID 88174029
2,2,3,3,4,4,5,5,6,6,7,7,8,8-Tetradecafluoro-1,9-bis(prop-1-en-2-yloxy)nonane
CID 138628062

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-9-prop-1-en-2-yloxynonane?
The IUPAC name of 1-fluoro-9-prop-1-en-2-yloxynonane (CID 176669375) is 1-fluoro-9-prop-1-en-2-yloxynonane.
What is the SMILES notation for 1-fluoro-9-prop-1-en-2-yloxynonane?
The canonical SMILES for 1-fluoro-9-prop-1-en-2-yloxynonane is C=C(C)OCCCCCCCCCF.
What is the InChIKey of 1-fluoro-9-prop-1-en-2-yloxynonane?
The InChIKey is JYLMMMWLWPFOGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23FO/c1-12(2)14-11-9-7-5-3-4-6-8-10-13/h1,3-11H2,2H3.
What are the key properties of 1-fluoro-9-prop-1-en-2-yloxynonane?
1-fluoro-9-prop-1-en-2-yloxynonane has a molecular weight of 202.31 g/mol, XLogP of 4.24, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-9-prop-1-en-2-yloxynonane is sourced from PubChem (CID 176669375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).