Vinylcyclohexene

Details

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Internal ID 1bfa400d-4484-4133-b1ef-7d955f703104
Taxonomy Hydrocarbons > Unsaturated hydrocarbons > Branched unsaturated hydrocarbons
IUPAC Name 1-ethenylcyclohexene
SMILES (Canonical) C=CC1=CCCCC1
SMILES (Isomeric) C=CC1=CCCCC1
InChI InChI=1S/C8H12/c1-2-8-6-4-3-5-7-8/h2,6H,1,3-5,7H2
InChI Key SDRZFSPCVYEJTP-UHFFFAOYSA-N
Popularity 201 references in papers

Physical and Chemical Properties

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Molecular Formula C8H12
Molecular Weight 108.18 g/mol
Exact Mass 108.093900383 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 2.80

Synonyms

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1-Vinylcyclohexene
1-ETHENYLCYCLOHEXENE
Cyclohexene, 1-ethenyl-
1-Vinyl-1-cyclohexene
Cyclohexene, ethenyl-
2622-21-1
Cyclohexene, 1-vinyl-
1-vinyl-cyclohexene
25168-07-4
2-Vinylcyclohexene
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Vinylcyclohexene

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
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 91.90% 91.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 86.30% 95.56%
CHEMBL4208 P20618 Proteasome component C5 84.85% 90.00%
CHEMBL2581 P07339 Cathepsin D 81.49% 98.95%

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.
Helianthus tuberosus

Cross-Links

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PubChem 17497
LOTUS LTS0117317
wikiData Q81984873