1-fluoro-4-non-8-enylbenzene

C15H21F — CID 57222789

IUPAC1-fluoro-4-non-8-enylbenzene
SMILESC=CCCCCCCCc1ccc(F)cc1
InChIInChI=1S/C15H21F/c1-2-3-4-5-6-7-8-9-14-10-12-15(16)13-11-14/h2,10-13H,1,3-9H2
InChIKeyOEAGCGAIEDHWKP-UHFFFAOYSA-N
MW220.33 g/mol
LogP4.89
Rot. Bonds8

About 1-fluoro-4-non-8-enylbenzene

1-fluoro-4-non-8-enylbenzene (PubChem CID 57222789) has the molecular formula C15H21F and a molecular weight of 220.33 g/mol. Its IUPAC name is 1-fluoro-4-non-8-enylbenzene.

Molecular Properties

Compound Name1-fluoro-4-non-8-enylbenzene
PubChem CID57222789
Molecular FormulaC15H21F
Molecular Weight220.33 g/mol
Exact Mass220.16
IUPAC Name1-fluoro-4-non-8-enylbenzene
SMILESC=CCCCCCCCc1ccc(F)cc1
InChIInChI=1S/C15H21F/c1-2-3-4-5-6-7-8-9-14-10-12-15(16)13-11-14/h2,10-13H,1,3-9H2
InChIKeyOEAGCGAIEDHWKP-UHFFFAOYSA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.33
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 91553239
hept-6-enylbenzene
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1-but-3-enyl-4-(4-fluorophenyl)benzene
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(E)-N-[(E)-(4-fluorophenyl)methylideneamino]-1-(4-pent-4-enylphenyl)methanimine
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1-fluoro-4-[4-[(E)-7-fluorohept-6-enyl]phenyl]benzene
CID 19798855
1-fluoro-4-[4-(8-fluorooct-7-enyl)phenyl]benzene
CID 54280038
1-hex-5-enyl-4-phenylbenzene
CID 59235470
1-hex-5-enyl-4-(4-methylphenyl)benzene
CID 59812350
1,4-difluoro-2-[4-fluoro-2-(4-hex-5-enylphenyl)phenyl]benzene
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4-nonadec-18-enylbenzenediazonium
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Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-non-8-enylbenzene?
The IUPAC name of 1-fluoro-4-non-8-enylbenzene (CID 57222789) is 1-fluoro-4-non-8-enylbenzene.
What is the SMILES notation for 1-fluoro-4-non-8-enylbenzene?
The canonical SMILES for 1-fluoro-4-non-8-enylbenzene is C=CCCCCCCCc1ccc(F)cc1.
What is the InChIKey of 1-fluoro-4-non-8-enylbenzene?
The InChIKey is OEAGCGAIEDHWKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21F/c1-2-3-4-5-6-7-8-9-14-10-12-15(16)13-11-14/h2,10-13H,1,3-9H2.
What are the key properties of 1-fluoro-4-non-8-enylbenzene?
1-fluoro-4-non-8-enylbenzene has a molecular weight of 220.33 g/mol, XLogP of 4.89, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-non-8-enylbenzene is sourced from PubChem (CID 57222789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).