4-(1-Propen-1-yl)phenol

Details

Top
Internal ID 49cde566-44a2-4ed6-958a-40ee6640e438
Taxonomy Benzenoids > Benzene and substituted derivatives > Styrenes
IUPAC Name 4-prop-1-enylphenol
SMILES (Canonical) CC=CC1=CC=C(C=C1)O
SMILES (Isomeric) CC=CC1=CC=C(C=C1)O
InChI InChI=1S/C9H10O/c1-2-3-8-4-6-9(10)7-5-8/h2-7,10H,1H3
InChI Key UMFCIIBZHQXRCJ-UHFFFAOYSA-N
Popularity 15 references in papers

Physical and Chemical Properties

Top
Molecular Formula C9H10O
Molecular Weight 134.17 g/mol
Exact Mass 134.073164938 g/mol
Topological Polar Surface Area (TPSA) 20.20 Ų
XlogP 2.60

Synonyms

Top
4-(1-Propen-1-yl)phenol
DTXSID401345962

2D Structure

Top
2D Structure of 4-(1-Propen-1-yl)phenol

3D Structure

Top

ADMET Properties (via admetSAR 2)

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

Targets

Top

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
CHEMBL242 Q92731 Estrogen receptor beta 95.33% 98.35%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 89.33% 91.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 87.16% 95.56%
CHEMBL1951 P21397 Monoamine oxidase A 84.19% 91.49%
CHEMBL3194 P02766 Transthyretin 83.95% 90.71%
CHEMBL1293249 Q13887 Kruppel-like factor 5 83.03% 86.33%
CHEMBL2039 P27338 Monoamine oxidase B 82.80% 92.51%
CHEMBL2581 P07339 Cathepsin D 80.71% 98.95%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 80.13% 96.00%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 80.09% 96.09%

Plants that contains it

Top
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.
Cardiocrinum cordatum
Coreopsis gigantea
Osmorhiza aristata
Solidago odora

Cross-Links

Top
PubChem 415627
LOTUS LTS0181496
wikiData Q26900199