tetradeca-4,9-dienal

C14H24O — CID 73196319

IUPACtetradeca-4,9-dienal
SMILESCCCCC=CCCCC=CCCC=O
InChIInChI=1S/C14H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h5-6,10-11,14H,2-4,7-9,12-13H2,1H3
InChIKeySKBKGBGBUQMBNN-UHFFFAOYSA-N
MW208.34 g/mol
LogP4.44
Rot. Bonds10

About tetradeca-4,9-dienal

tetradeca-4,9-dienal (PubChem CID 73196319) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is tetradeca-4,9-dienal.

Molecular Properties

Compound Nametetradeca-4,9-dienal
PubChem CID73196319
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Nametetradeca-4,9-dienal
SMILESCCCCC=CCCCC=CCCC=O
InChIInChI=1S/C14H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h5-6,10-11,14H,2-4,7-9,12-13H2,1H3
InChIKeySKBKGBGBUQMBNN-UHFFFAOYSA-N
XLogP4.44
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

hexadeca-7,11-dienal
CID 543335
(E)-octadec-13-enal
CID 5367670
(6E,12E)-octadeca-6,12-dienal
CID 10220937
undeca-4,9-dienal
CID 72565371
(E)-tetradec-7-enal
CID 5283367
tetracos-11-enal
CID 173212441
(E)-hexacos-17-enal
CID 20847611
(Z)-tetradec-8-enal
CID 6430188
(E)-heptadec-6-enal
CID 122214705
(E)-octacos-19-enal
CID 25245229
(E)-octadec-8-enal
CID 5365013
(Z)-pentadec-6-enal
CID 10489351

Frequently Asked Questions

What is the IUPAC name of tetradeca-4,9-dienal?
The IUPAC name of tetradeca-4,9-dienal (CID 73196319) is tetradeca-4,9-dienal.
What is the SMILES notation for tetradeca-4,9-dienal?
The canonical SMILES for tetradeca-4,9-dienal is CCCCC=CCCCC=CCCC=O.
What is the InChIKey of tetradeca-4,9-dienal?
The InChIKey is SKBKGBGBUQMBNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h5-6,10-11,14H,2-4,7-9,12-13H2,1H3.
What are the key properties of tetradeca-4,9-dienal?
tetradeca-4,9-dienal has a molecular weight of 208.34 g/mol, XLogP of 4.44, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tetradeca-4,9-dienal is sourced from PubChem (CID 73196319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).