10-fluorodec-1-yne

C10H17F — CID 86175475

IUPAC10-fluorodec-1-yne
SMILESC#CCCCCCCCCF
InChIInChI=1S/C10H17F/c1-2-3-4-5-6-7-8-9-10-11/h1H,3-10H2
InChIKeyAPRAWEYWAFTPKI-UHFFFAOYSA-N
MW156.24 g/mol
LogP3.32
Rot. Bonds7

About 10-fluorodec-1-yne

10-fluorodec-1-yne (PubChem CID 86175475) has the molecular formula C10H17F and a molecular weight of 156.24 g/mol. Its IUPAC name is 10-fluorodec-1-yne.

Molecular Properties

Compound Name10-fluorodec-1-yne
PubChem CID86175475
Molecular FormulaC10H17F
Molecular Weight156.24 g/mol
Exact Mass156.13
IUPAC Name10-fluorodec-1-yne
SMILESC#CCCCCCCCCF
InChIInChI=1S/C10H17F/c1-2-3-4-5-6-7-8-9-10-11/h1H,3-10H2
InChIKeyAPRAWEYWAFTPKI-UHFFFAOYSA-N
XLogP3.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.24
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 10-fluorodec-1-yne?
The IUPAC name of 10-fluorodec-1-yne (CID 86175475) is 10-fluorodec-1-yne.
What is the SMILES notation for 10-fluorodec-1-yne?
The canonical SMILES for 10-fluorodec-1-yne is C#CCCCCCCCCF.
What is the InChIKey of 10-fluorodec-1-yne?
The InChIKey is APRAWEYWAFTPKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F/c1-2-3-4-5-6-7-8-9-10-11/h1H,3-10H2.
What are the key properties of 10-fluorodec-1-yne?
10-fluorodec-1-yne has a molecular weight of 156.24 g/mol, XLogP of 3.32, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10-fluorodec-1-yne is sourced from PubChem (CID 86175475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).