2,4-Hexadienaldehyd

Details

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Internal ID 0adf77a0-5ca5-40df-87a3-16ebe0310d30
Taxonomy Organic oxygen compounds > Organooxygen compounds > Carbonyl compounds > Aldehydes > Medium-chain aldehydes
IUPAC Name hexa-2,4-dienal
SMILES (Canonical) CC=CC=CC=O
SMILES (Isomeric) CC=CC=CC=O
InChI InChI=1S/C6H8O/c1-2-3-4-5-6-7/h2-6H,1H3
InChI Key BATOPAZDIZEVQF-UHFFFAOYSA-N
Popularity 36 references in papers

Physical and Chemical Properties

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Molecular Formula C6H8O
Molecular Weight 96.13 g/mol
Exact Mass 96.057514874 g/mol
Topological Polar Surface Area (TPSA) 17.10 Ų
XlogP 1.20

Synonyms

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CCRIS 5124
DTXSID20859279
BATOPAZDIZEVQF-UHFFFAOYSA-N
NSC 16184
NSC 68096
AKOS030228154
SB85358
FT-0604957

2D Structure

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2D Structure of 2,4-Hexadienaldehyd

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 82.95% 95.56%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Medicago sativa

Cross-Links

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PubChem 8901
LOTUS LTS0156098
wikiData Q104922437