WHC is still in active development. Read this to understand our approach.
depiction of ZFMSMUAANRJZFM-UHFFFAOYSA-N.svg
isomerdesign

Estragole

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pubchem

Estragole

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Data

InChI: InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3

Synonyms: 4-Allylanisole, >=98%, FCC,Estragole (natural),FT-0617414,1-METHOXY-4-(2-PROPENYL)BENZENE [HSDB],Methyl chavicole,NSC-404113,Estragol (methylchavicol),140-67-0,Benzene, 1-methoxy, 4-prop-2-enyl,DSSTox_GSID_20575,4-Allyl-1-methoxybenzene,1 -Methoxy-4-(2-propenyl) benzene,4-Methoxyphenylprop-2-ene,1407-27-8,MFCD00008653,4-Allylphenyl methyl ether,Anisole, p-allyl-,ESTRAGOLE [FCC],p-Allylphenyl methyl ether,1-methoxy-4-(prop-2-en-1-yl)benzene,4-06-00-03817 (Beilstein Handbook Reference),1-Allyl-4-methoxybenzene,NCGC00091434-01,Terragon,p-Methoxyallylbenzene,Benzene, 1-methoxy-4-(2-propen-1-yl)-,EN300-21676,Estragol,p-Allylmethoxybenzene,EPA Pesticide Chemical Code 062150,ESTRAGOLE [FHFI],Isoanthethole,1-Methoxy-4-(2-propen-1-yl)-Benzene,SPECTRUM1505117,CCRIS 1317,4-Allylanisole, 98%,DTXSID0020575,4-Allylmethoxybenzene,NSC404113,Chavicyl methyl ether,DSSTox_RID_75667,Methyl chavicole (estragole),EINECS 205-427-8,p-Allyl-Anisole,Esdragole,HY-N5060,p-Allylanisole,Chavicol, O-methyl-,Esdragol,Esdragon,1-methoxy-4-(2-propenyl)-benzene,3-(p-Methoxyphenyl)propene,Tarragon,Ether, p-allylphenyl methyl,1-Methoxy-4-(2-propen-1-yl)benzene,Esteragol,4-methoxy allylbenzene,4-Allylanisole, analytical standard,Estragole, analytical standard,AKOS000121300,Allylphenyl methyl ether, p-,AUSTL 21320,9NIW07V3ET,CHEBI:4867,1-Methoxy-4-(2-propenyl)benzene, 9CI,SR-01000838348,Methyl chavicol,1-METHOXY-4-(2-PROPENYL)BENZENE,HSDB 5412,AI3-16052,4-Methoxyallylbenzene,FEMA Number 2411,Q419495,UNII-9NIW07V3ET,DSSTox_CID_575,ESTRAGOLE [MI],BENZENE,1-ALLYL,4-METHOXY METHYLCHAVICOL,CS-0032231,para-allylanisole,NCGC00259936-01,Methyl-Chavicol,Tox21_302930,ZINC967635,p-methoxy allylbenzene,NSC 404113,Isoanethole,Benzene, 1-methoxy-4-(2-propenyl)-,4-Allylanisole,BENZENE,1-ALLYL,4-METHOXY METHYLCHAVICOL,O-Methyl-Chavicol,FEMA No. 2411,Chavicol, methyl-,FEMA 2411,SCHEMBL57204,Tox21_202387,3-(4-Methoxyphenyl)-1-propene,NCI-C60946,SMR000112379,4-allylanisol,Methylchavicol,s5339,J-007415,NCGC00256481-01,1-methoxy-4-prop-2-enylbenzene,MLS001065575,WLN: 1U2R DO1,p-allylanisole, 4-allyl-1-methoxybenzene, methyl chavicol,AS-35303,1-allyl-4-methoxy-benzene,NCGC00091434-03,CAS-140-67-0,Estragole,CCG-214642,4-Allylanisole, purum, >=97.0% (GC),Chavicol methyl ether,1-Methoxy-4-prop-2-enyl-benzene,CHEMBL470671,Para-allylanisole (estragole),77525-18-9,SR-01000838348-2,HMS2268E24,NCGC00091434-02,A0702,BRN 1099454

Estimated data

Solubility: -2.614 (log(S) in mol/L prediction using SolTranNet)

Blood Brain Barrier Permeability: Yes (prediction using frontiersin.org)

Addictivity Prediction: 56.2% (prediction based on www.mdpi.com)

Similarities

The following is a set of comparisons to understand the properties of this compound. This is still higly experimental and is still under active development. Please refer to our series of blog posts to fully understand our approach and its limitations. This information is for informational purposes only and should not be construed as medical advice.