1-fluoronona-1,2-dienylbenzene

C15H19F — CID 174565883

IUPAC1-fluoronona-1,2-dienylbenzene
SMILESCCCCCCC=C=C(F)c1ccccc1
InChIInChI=1S/C15H19F/c1-2-3-4-5-6-10-13-15(16)14-11-8-7-9-12-14/h7-12H,2-6H2,1H3
InChIKeyCNFYSOPTYTXWMJ-UHFFFAOYSA-N
MW218.32 g/mol
LogP5.12
Rot. Bonds6

About 1-fluoronona-1,2-dienylbenzene

1-fluoronona-1,2-dienylbenzene (PubChem CID 174565883) has the molecular formula C15H19F and a molecular weight of 218.32 g/mol. Its IUPAC name is 1-fluoronona-1,2-dienylbenzene.

Molecular Properties

Compound Name1-fluoronona-1,2-dienylbenzene
PubChem CID174565883
Molecular FormulaC15H19F
Molecular Weight218.32 g/mol
Exact Mass218.15
IUPAC Name1-fluoronona-1,2-dienylbenzene
SMILESCCCCCCC=C=C(F)c1ccccc1
InChIInChI=1S/C15H19F/c1-2-3-4-5-6-10-13-15(16)14-11-8-7-9-12-14/h7-12H,2-6H2,1H3
InChIKeyCNFYSOPTYTXWMJ-UHFFFAOYSA-N
XLogP5.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500218.32
LogP ≤ 55.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

trideca-1,2-dienylbenzene
CID 12769944
sodium;hydride;1-phenyltetradec-1-enylbenzene
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2-fluoro-1-phenyloct-2-en-1-one
CID 71437932
2-phenylundec-2-ene-1-thiol
CID 175069404
octa-1,2-dienylbenzene
CID 12066892
decanal;1-phenylethanone
CID 161488656
2-methylocta-2,3-dienylbenzene
CID 42604070
N-decylidenebenzamide
CID 90984528
triethyl-[(1E)-2-methyl-1-phenylundeca-1,3,4-trien-3-yl]oxysilane
CID 46895399
8-phenyltetradec-7-en-7-ylbenzene
CID 141438246
2-butyl-1-phenylnon-2-en-1-one
CID 57359358
2-phenyldeca-3,4-dien-2-ol
CID 10988074

Frequently Asked Questions

What is the IUPAC name of 1-fluoronona-1,2-dienylbenzene?
The IUPAC name of 1-fluoronona-1,2-dienylbenzene (CID 174565883) is 1-fluoronona-1,2-dienylbenzene.
What is the SMILES notation for 1-fluoronona-1,2-dienylbenzene?
The canonical SMILES for 1-fluoronona-1,2-dienylbenzene is CCCCCCC=C=C(F)c1ccccc1.
What is the InChIKey of 1-fluoronona-1,2-dienylbenzene?
The InChIKey is CNFYSOPTYTXWMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F/c1-2-3-4-5-6-10-13-15(16)14-11-8-7-9-12-14/h7-12H,2-6H2,1H3.
What are the key properties of 1-fluoronona-1,2-dienylbenzene?
1-fluoronona-1,2-dienylbenzene has a molecular weight of 218.32 g/mol, XLogP of 5.12, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoronona-1,2-dienylbenzene is sourced from PubChem (CID 174565883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).