4-Penten-2-OL

Details

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Internal ID cc5370ca-53e2-42e4-849d-486b67a8562d
Taxonomy Organic oxygen compounds > Organooxygen compounds > Alcohols and polyols > Secondary alcohols
IUPAC Name pent-4-en-2-ol
SMILES (Canonical) CC(CC=C)O
SMILES (Isomeric) CC(CC=C)O
InChI InChI=1S/C5H10O/c1-3-4-5(2)6/h3,5-6H,1,4H2,2H3
InChI Key ZHZCYWWNFQUZOR-UHFFFAOYSA-N
Popularity 44 references in papers

Physical and Chemical Properties

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Molecular Formula C5H10O
Molecular Weight 86.13 g/mol
Exact Mass 86.073164938 g/mol
Topological Polar Surface Area (TPSA) 20.20 Ų
XlogP 1.10

Synonyms

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625-31-0
pent-4-en-2-ol
1-Penten-4-ol
4-Hydroxypent-1-ene
MFCD00004556
penten-4-ol
NSC65447
EINECS 210-887-8
NSC 65447
AI3-28609
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of 4-Penten-2-OL

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
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 90.99% 96.09%
CHEMBL2581 P07339 Cathepsin D 89.14% 98.95%
CHEMBL2885 P07451 Carbonic anhydrase III 86.24% 87.45%

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.
Sphagneticola trilobata

Cross-Links

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PubChem 12247
LOTUS LTS0168391
wikiData Q72500055