U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C14H20O
Molecular Weight 204.308
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUTYLPHENYL METHYLPROPIONAL

SMILES

CC(CC1=CC=C(C=C1)C(C)(C)C)C=O

InChI

InChIKey=SDQFDHOLCGWZPU-UHFFFAOYSA-N
InChI=1S/C14H20O/c1-11(10-15)9-12-5-7-13(8-6-12)14(2,3)4/h5-8,10-11H,9H2,1-4H3

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
A psychophysical study of the relationship between temporal processing in odor mixtures and transduction pathways.
2001 Oct
Ethanol and diethyl phthalate: vehicle effects in the local lymph node assay.
2004 May-Jun
Prediction of perception: probing the hOR17-4 olfactory receptor model with silicon analogues of bourgeonal and lilial.
2007
Sensitization to 26 fragrances to be labelled according to current European regulation. Results of the IVDK and review of the literature.
2007 Jul
HMOX1 and NQO1 genes are upregulated in response to contact sensitizers in dendritic cells and THP-1 cell line: role of the Keap1/Nrf2 pathway.
2009 Feb
Oestrogenic activity of benzyl salicylate, benzyl benzoate and butylphenylmethylpropional (Lilial) in MCF7 human breast cancer cells in vitro.
2009 Jul
Polyvalent type IV sensitizations to multiple fragrances and a skin protection cream in a metal worker.
2009 Jun
Quantitative determination of some volatile suspected allergens in cosmetic creams spread on skin by direct contact sorptive tape extraction-gas chromatography-mass spectrometry.
2010 Apr 16
Sorbent trapping solid-phase microextraction of fragrance allergens in indoor air.
2010 Aug 13
Determination of suspected allergens in cosmetic products by headspace-programmed temperature vaporization-fast gas chromatography-quadrupole mass spectrometry.
2010 Jul
Chemoreception regulates chemical access to mouse vomeronasal organ: role of solitary chemosensory cells.
2010 Jul 30
Bioreduction of alpha-methylcinnamaldehyde derivatives: chemo-enzymatic asymmetric synthesis of Lilial and Helional.
2010 Sep 28
Patents
Name Type Language
BUTYLPHENYL METHYLPROPIONAL
INCI  
INCI  
Official Name English
LILESTRAL
Common Name English
.BETA.-LILIAL
Brand Name English
2-(4-TERT-BUTYLBENZYL)PROPIONALDEHYDE
Systematic Name English
PT-BUCINAL
Common Name English
3-(4-TERT-BUTYLPHENYL)-2-METHYLPROPANAL
Systematic Name English
LILIAL
Brand Name English
LILESTRALIS
Common Name English
BUTYLPHENYL METHYLPROPIONAL [INCI]
Common Name English
P-T-BUTYL-ALPHA-METHYLHYDROCINNAMIC ALDEHYDE
Common Name English
(±)-2-METHYL-3-(4-TERT-BUTYLPHENYL)PROPANAL
Systematic Name English
NSC-22275
Code English
LILY ALDEHYDE
Common Name English
.ALPHA.-METHYL-P-TERT-BUTYLHYDROCINNAMALDEHYDE
Common Name English
(±)-BUTYLPHENYL METHYLPROPIONAL
Common Name English
LYSMERAL
Common Name English
BENZENEPROPANAL, 4-(1,1-DIMETHYLETHYL)-.ALPHA.-METHYL-
Systematic Name English
P-TERT-BUTYL-.ALPHA.-METHYLHYDROCINNAMIC ALDEHYDE
Common Name English
2(4-TERT-BUTYLBENZYL) PROPIONALDEHYDE
Systematic Name English
Classification Tree Code System Code
EC SCIENTIFIC COMMITTEE ON CONSUMER SAFETY OPINION SCCS/1459/11
Created by admin on Fri Dec 15 16:58:44 GMT 2023 , Edited by admin on Fri Dec 15 16:58:44 GMT 2023
Code System Code Type Description
EVMPD
SUB169890
Created by admin on Fri Dec 15 16:58:44 GMT 2023 , Edited by admin on Fri Dec 15 16:58:44 GMT 2023
PRIMARY
ECHA (EC/EINECS)
201-289-8
Created by admin on Fri Dec 15 16:58:44 GMT 2023 , Edited by admin on Fri Dec 15 16:58:44 GMT 2023
PRIMARY
EVMPD
SUB177804
Created by admin on Fri Dec 15 16:58:44 GMT 2023 , Edited by admin on Fri Dec 15 16:58:44 GMT 2023
PRIMARY
EPA CompTox
DTXSID9026500
Created by admin on Fri Dec 15 16:58:44 GMT 2023 , Edited by admin on Fri Dec 15 16:58:44 GMT 2023
PRIMARY
FDA UNII
T7540GJV69
Created by admin on Fri Dec 15 16:58:44 GMT 2023 , Edited by admin on Fri Dec 15 16:58:44 GMT 2023
PRIMARY
CAS
80-54-6
Created by admin on Fri Dec 15 16:58:44 GMT 2023 , Edited by admin on Fri Dec 15 16:58:44 GMT 2023
PRIMARY
WIKIPEDIA
LILIAL
Created by admin on Fri Dec 15 16:58:44 GMT 2023 , Edited by admin on Fri Dec 15 16:58:44 GMT 2023
PRIMARY
PUBCHEM
228987
Created by admin on Fri Dec 15 16:58:44 GMT 2023 , Edited by admin on Fri Dec 15 16:58:44 GMT 2023
PRIMARY
DAILYMED
T7540GJV69
Created by admin on Fri Dec 15 16:58:44 GMT 2023 , Edited by admin on Fri Dec 15 16:58:44 GMT 2023
PRIMARY
NSC
22275
Created by admin on Fri Dec 15 16:58:44 GMT 2023 , Edited by admin on Fri Dec 15 16:58:44 GMT 2023
PRIMARY
RXCUI
1307156
Created by admin on Fri Dec 15 16:58:44 GMT 2023 , Edited by admin on Fri Dec 15 16:58:44 GMT 2023
PRIMARY RxNorm
SMS_ID
100000159599
Created by admin on Fri Dec 15 16:58:44 GMT 2023 , Edited by admin on Fri Dec 15 16:58:44 GMT 2023
PRIMARY