1-[(E)-tetradec-11-enyl]naphthalene

C24H34 — CID 101307515

IUPAC1-[(E)-tetradec-11-enyl]naphthalene
SMILESCC/C=C/CCCCCCCCCCc1cccc2ccccc12
InChIInChI=1S/C24H34/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-22-19-16-20-23-18-14-15-21-24(22)23/h3-4,14-16,18-21H,2,5-13,17H2,1H3/b4-3+
InChIKeyNKXOQTZDATZGGE-ONEGZZNKSA-N
MW322.54 g/mol
LogP7.86
Rot. Bonds12

About 1-[(E)-tetradec-11-enyl]naphthalene

1-[(E)-tetradec-11-enyl]naphthalene (PubChem CID 101307515) has the molecular formula C24H34 and a molecular weight of 322.54 g/mol. Its IUPAC name is 1-[(E)-tetradec-11-enyl]naphthalene.

Molecular Properties

Compound Name1-[(E)-tetradec-11-enyl]naphthalene
PubChem CID101307515
Molecular FormulaC24H34
Molecular Weight322.54 g/mol
Exact Mass322.27
IUPAC Name1-[(E)-tetradec-11-enyl]naphthalene
SMILESCC/C=C/CCCCCCCCCCc1cccc2ccccc12
InChIInChI=1S/C24H34/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-22-19-16-20-23-18-14-15-21-24(22)23/h3-4,14-16,18-21H,2,5-13,17H2,1H3/b4-3+
InChIKeyNKXOQTZDATZGGE-ONEGZZNKSA-N
XLogP7.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.54
LogP ≤ 57.86
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

1-[(E)-heptadec-10-enyl]naphthalene
CID 101307596
1-[(E)-undec-6-enyl]naphthalene
CID 101304389
1-[(E)-pentadec-7-enyl]naphthalene
CID 101307533
1-[(E)-icos-9-enyl]naphthalene
CID 101307696
1-[(E)-octadec-13-enyl]naphthalene
CID 101307634
1-[(E)-henicos-4-enyl]naphthalene
CID 101307724
1-[(E)-henicos-19-enyl]naphthalene
CID 101307754
1-[(E)-heptadec-3-enyl]naphthalene
CID 101307582
1-[(E)-docos-3-enyl]naphthalene
CID 101307762
1-tetradecylnaphthalene
CID 14402128
1-non-8-enylnaphthalene
CID 101304361
1-[(E)-pentadec-2-enyl]naphthalene
CID 101307523

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-tetradec-11-enyl]naphthalene?
The IUPAC name of 1-[(E)-tetradec-11-enyl]naphthalene (CID 101307515) is 1-[(E)-tetradec-11-enyl]naphthalene.
What is the SMILES notation for 1-[(E)-tetradec-11-enyl]naphthalene?
The canonical SMILES for 1-[(E)-tetradec-11-enyl]naphthalene is CC/C=C/CCCCCCCCCCc1cccc2ccccc12.
What is the InChIKey of 1-[(E)-tetradec-11-enyl]naphthalene?
The InChIKey is NKXOQTZDATZGGE-ONEGZZNKSA-N. The full InChI is InChI=1S/C24H34/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-22-19-16-20-23-18-14-15-21-24(22)23/h3-4,14-16,18-21H,2,5-13,17H2,1H3/b4-3+.
What are the key properties of 1-[(E)-tetradec-11-enyl]naphthalene?
1-[(E)-tetradec-11-enyl]naphthalene has a molecular weight of 322.54 g/mol, XLogP of 7.86, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-tetradec-11-enyl]naphthalene is sourced from PubChem (CID 101307515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).