dec-1-ene;1H-phenalene

C23H30 — CID 174935636

IUPACdec-1-ene;1H-phenalene
SMILESC1=Cc2cccc3cccc(c23)C1.C=CCCCCCCCC
InChIInChI=1S/C13H10.C10H20/c1-4-10-6-2-8-12-9-3-7-11(5-1)13(10)12;1-3-5-7-9-10-8-6-4-2/h1-8H,9H2;3H,1,4-10H2,2H3
InChIKeyNAFKTLXMZTXDNL-UHFFFAOYSA-N
MW306.49 g/mol
LogP7.33
Rot. Bonds7

About dec-1-ene;1H-phenalene

dec-1-ene;1H-phenalene (PubChem CID 174935636) has the molecular formula C23H30 and a molecular weight of 306.49 g/mol. Its IUPAC name is dec-1-ene;1H-phenalene.

Molecular Properties

Compound Namedec-1-ene;1H-phenalene
PubChem CID174935636
Molecular FormulaC23H30
Molecular Weight306.49 g/mol
Exact Mass306.23
IUPAC Namedec-1-ene;1H-phenalene
SMILESC1=Cc2cccc3cccc(c23)C1.C=CCCCCCCCC
InChIInChI=1S/C13H10.C10H20/c1-4-10-6-2-8-12-9-3-7-11(5-1)13(10)12;1-3-5-7-9-10-8-6-4-2/h1-8H,9H2;3H,1,4-10H2,2H3
InChIKeyNAFKTLXMZTXDNL-UHFFFAOYSA-N
XLogP7.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.49
LogP ≤ 57.33
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

1H-phenalene;hydrofluoride
CID 174317076
benzene;1H-phenalene;sulfane
CID 174365170
1H-phenalene;propanoic acid
CID 174844804
ethane;isocyanic acid;1H-phenalene
CID 175301579
2-amino-2-(hydroxymethyl)propane-1,3-diol;1H-phenalene
CID 146465575
bis(4,5-dihydro-1,3-oxazole);1H-phenalene
CID 66750988
tris(2H-oxazine);1H-phenalene
CID 68866882
non-1-ene
CID 141296734
hexane;octadec-1-ene
CID 175577514
octadeca-1,17-diene;tetradec-1-ene
CID 173070986
octadec-1-ene;tetradec-1-ene
CID 158470925
dec-1-ene;dodec-1-ene;tetradec-1-ene
CID 159177706

Frequently Asked Questions

What is the IUPAC name of dec-1-ene;1H-phenalene?
The IUPAC name of dec-1-ene;1H-phenalene (CID 174935636) is dec-1-ene;1H-phenalene.
What is the SMILES notation for dec-1-ene;1H-phenalene?
The canonical SMILES for dec-1-ene;1H-phenalene is C1=Cc2cccc3cccc(c23)C1.C=CCCCCCCCC.
What is the InChIKey of dec-1-ene;1H-phenalene?
The InChIKey is NAFKTLXMZTXDNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10.C10H20/c1-4-10-6-2-8-12-9-3-7-11(5-1)13(10)12;1-3-5-7-9-10-8-6-4-2/h1-8H,9H2;3H,1,4-10H2,2H3.
What are the key properties of dec-1-ene;1H-phenalene?
dec-1-ene;1H-phenalene has a molecular weight of 306.49 g/mol, XLogP of 7.33, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dec-1-ene;1H-phenalene is sourced from PubChem (CID 174935636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).