10-ethenyl-3-hexylfluoranthene

C24H24 — CID 102281616

IUPAC10-ethenyl-3-hexylfluoranthene
SMILESC=Cc1cccc2c1-c1ccc(CCCCCC)c3cccc-2c13
InChIInChI=1S/C24H24/c1-3-5-6-7-10-18-15-16-22-23-17(4-2)11-8-13-20(23)21-14-9-12-19(18)24(21)22/h4,8-9,11-16H,2-3,5-7,10H2,1H3
InChIKeyHPRTXODONYSVKV-UHFFFAOYSA-N
MW312.46 g/mol
LogP7.25
Rot. Bonds6

About 10-ethenyl-3-hexylfluoranthene

10-ethenyl-3-hexylfluoranthene (PubChem CID 102281616) has the molecular formula C24H24 and a molecular weight of 312.46 g/mol. Its IUPAC name is 10-ethenyl-3-hexylfluoranthene.

Molecular Properties

Compound Name10-ethenyl-3-hexylfluoranthene
PubChem CID102281616
Molecular FormulaC24H24
Molecular Weight312.46 g/mol
Exact Mass312.19
IUPAC Name10-ethenyl-3-hexylfluoranthene
SMILESC=Cc1cccc2c1-c1ccc(CCCCCC)c3cccc-2c13
InChIInChI=1S/C24H24/c1-3-5-6-7-10-18-15-16-22-23-17(4-2)11-8-13-20(23)21-14-9-12-19(18)24(21)22/h4,8-9,11-16H,2-3,5-7,10H2,1H3
InChIKeyHPRTXODONYSVKV-UHFFFAOYSA-N
XLogP7.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.46
LogP ≤ 57.25
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

1,2-bis(ethenyl)-3-octadecylbenzene
CID 18628258
1-ethenyl-2-pentylbenzene
CID 22171756
1,3-didecyl-2-ethenylbenzene
CID 10572118
1-heptyl-4-[3-(4-heptylnaphthalen-1-yl)propyl]naphthalene
CID 157140020
1,2-bis(ethenyl)benzene;hexylbenzene
CID 175593213
4-ethyl-1,5-dipentylnaphthalene
CID 90697444
1-hexadecylpyrene
CID 12966317
1-hexyl-4-propylnaphthalene
CID 173269452
4,9-dihexylpicene
CID 58426524
4,9-didodecylpicene
CID 58426566
1-ethenyl-2-(4-hexylphenyl)benzene
CID 173095750
1-tetradecylnaphthalene
CID 14402128

Frequently Asked Questions

What is the IUPAC name of 10-ethenyl-3-hexylfluoranthene?
The IUPAC name of 10-ethenyl-3-hexylfluoranthene (CID 102281616) is 10-ethenyl-3-hexylfluoranthene.
What is the SMILES notation for 10-ethenyl-3-hexylfluoranthene?
The canonical SMILES for 10-ethenyl-3-hexylfluoranthene is C=Cc1cccc2c1-c1ccc(CCCCCC)c3cccc-2c13.
What is the InChIKey of 10-ethenyl-3-hexylfluoranthene?
The InChIKey is HPRTXODONYSVKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24/c1-3-5-6-7-10-18-15-16-22-23-17(4-2)11-8-13-20(23)21-14-9-12-19(18)24(21)22/h4,8-9,11-16H,2-3,5-7,10H2,1H3.
What are the key properties of 10-ethenyl-3-hexylfluoranthene?
10-ethenyl-3-hexylfluoranthene has a molecular weight of 312.46 g/mol, XLogP of 7.25, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10-ethenyl-3-hexylfluoranthene is sourced from PubChem (CID 102281616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).