undeca-1,10-dien-3-ylcyclohexane

C17H30 — CID 54538592

IUPACundeca-1,10-dien-3-ylcyclohexane
SMILESC=CCCCCCCC(C=C)C1CCCCC1
InChIInChI=1S/C17H30/c1-3-5-6-7-8-10-13-16(4-2)17-14-11-9-12-15-17/h3-4,16-17H,1-2,5-15H2
InChIKeyZBNCMFHFLGISCE-UHFFFAOYSA-N
MW234.43 g/mol
LogP5.90
Rot. Bonds9

About undeca-1,10-dien-3-ylcyclohexane

undeca-1,10-dien-3-ylcyclohexane (PubChem CID 54538592) has the molecular formula C17H30 and a molecular weight of 234.43 g/mol. Its IUPAC name is undeca-1,10-dien-3-ylcyclohexane.

Molecular Properties

Compound Nameundeca-1,10-dien-3-ylcyclohexane
PubChem CID54538592
Molecular FormulaC17H30
Molecular Weight234.43 g/mol
Exact Mass234.23
IUPAC Nameundeca-1,10-dien-3-ylcyclohexane
SMILESC=CCCCCCCC(C=C)C1CCCCC1
InChIInChI=1S/C17H30/c1-3-5-6-7-8-10-13-16(4-2)17-14-11-9-12-15-17/h3-4,16-17H,1-2,5-15H2
InChIKeyZBNCMFHFLGISCE-UHFFFAOYSA-N
XLogP5.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500234.43
LogP ≤ 55.90
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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1-cyclohexyl-1-methoxynon-8-en-2-ol
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1-cyclohexyl-1-methoxynon-8-en-2-amine
CID 107009768
1-cyclohexyl-N-ethylnon-8-en-2-amine
CID 107011937
1-cyclohexyl-1-hydroxynon-8-en-2-one
CID 107008454
[(2R)-1-bromobut-3-en-2-yl]cyclohexane
CID 102075703
1-(1-hydroxyoct-7-enyl)cycloheptan-1-ol
CID 107008754
2-cyclopentylhept-6-enoic acid
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2-cyclohexylhex-5-en-1-amine
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heptacosa-1,26-diene
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Frequently Asked Questions

What is the IUPAC name of undeca-1,10-dien-3-ylcyclohexane?
The IUPAC name of undeca-1,10-dien-3-ylcyclohexane (CID 54538592) is undeca-1,10-dien-3-ylcyclohexane.
What is the SMILES notation for undeca-1,10-dien-3-ylcyclohexane?
The canonical SMILES for undeca-1,10-dien-3-ylcyclohexane is C=CCCCCCCC(C=C)C1CCCCC1.
What is the InChIKey of undeca-1,10-dien-3-ylcyclohexane?
The InChIKey is ZBNCMFHFLGISCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30/c1-3-5-6-7-8-10-13-16(4-2)17-14-11-9-12-15-17/h3-4,16-17H,1-2,5-15H2.
What are the key properties of undeca-1,10-dien-3-ylcyclohexane?
undeca-1,10-dien-3-ylcyclohexane has a molecular weight of 234.43 g/mol, XLogP of 5.90, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for undeca-1,10-dien-3-ylcyclohexane is sourced from PubChem (CID 54538592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).