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General Material Information

Preferred name cyclamen propanal
Trivial Name Bourgeonal
Short Description bourgeonal (Givaudan)
Formula C13 H18 O
CAS Number 18127-01-0
ECHA Number 242-016-2
FDA UNII H3XVS6E70V
Nikkaji Number J260.882K
Beilstein Number 2439407
MDL MFCD00169819
xLogP3-AA 3.30 (est)
Bio Activity Summary External link
NMR Predictor External link
Synonyms
  • benzenepropanal, 4-(1,1-dimethylethyl)-
  • bourgeonal (Givaudan)
  • burgeonal
  • p-tert- butyl dihydrocinnamaldehyde
  • para-tert- butyl dihydrocinnamaldehyde
  • para-tert- butyl hydrocinnamic aldehyde
  • 3-(4-tert- butyl phenyl) propanal
  • 3-(4-tert- butyl phenyl) propionaldehyde
  • 3-(4-tert- butyl-phenyl)propionaldehyde
  • 3-(4-(tert- butyl)phenyl)propanal
  • p-tert- butyldihydrocinnamaldehyde
  • para-tert- butyldihydrocinnamaldehyde
  • p-tert- butylhydrocinnamic aldehyde
  • 3-(4-tert- butylphenyl)propanal
  • 3-(4-tert- butylphenyl)propionaldehyde
  • 4-(1,1-dimethyl ethyl) benzene propanal
  • 3-(4-(1,1-dimethyl ethyl)-phenyl) propanal
  • 3-(4-(1,1-dimethylethyl)-phenyl)propanal
  • 4-(1,1-dimethylethyl)benzenepropanal
  • langeonal
  • lilional
  • lilional forte
  • liliphenal
  • 3-[4-(2-methyl-2-propanyl)phenyl]propanal
  • 3-(4-tert-butylphenyl)propanal
  • Hydrocinnamaldehyde, p-tert-butyl-
  • 4-(1,1-Dimethylethyl)benzenepropanal
  • p-tert-Butyldihydrocinnamaldehyde
  • Bourgeonal
  • 3-(p-tert-Butylphenyl)propanal

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Literature & References

3-(4-tert-butylphenyl)propanal
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:18127-01-0
Pubchem (cid):64832
Pubchem (sid):135021788
Publications by PubMed
Decreased perception of bourgeonal may be linked to male idiopathic infertility.
Human olfactory sensitivity for bourgeonal and male infertility: a preliminary investigation.
Novel bourgeonal fragrance conjugates for the detection of prostate cancer.
The CatSper channel: a polymodal chemosensor in human sperm.
Ultra-high olfactory sensitivity for the human sperm-attractant aromatic aldehyde bourgeonal in CD-1 mice.
Chemosensory Ca2+ dynamics correlate with diverse behavioral phenotypes in human sperm.
Designing exons for human olfactory receptor gene subfamilies using a mathematical paradigm.
Olfactory sensitivity for sperm-attractant aromatic aldehydes: a comparative study in human subjects and spider monkeys.
Human male superiority in olfactory sensitivity to the sperm attractant odorant bourgeonal.
Odor interaction between Bourgeonal and its antagonist undecanal.
Behavioral response of human spermatozoa to a concentration jump of chemoattractants or intracellular cyclic nucleotides.
Odorant design based on the carbon/silicon switch strategy.
Prediction of perception: probing the hOR17-4 olfactory receptor model with silicon analogues of bourgeonal and lilial.
Novel function of beta-arrestin2 in the nucleus of mature spermatozoa.
Olfaction: attracting both sperm and the nose.
Dual capacity of a human olfactory receptor.
Particulate adenylate cyclase plays a key role in human sperm olfactory receptor-mediated chemotaxis.
Identification of a testicular odorant receptor mediating human sperm chemotaxis.
Development. Smelling the roses?

Other Information

(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
CHEMBL:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2912.29.0090
ChemSpider:View
Wikipedia:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 190.28565979004
Specific gravity @ 25 °C
Pounds per Gallon 7.947 to 7.996
Refractive Index 1.508 to 1.512 @ 20 °C
Vapor Pressure 0.009 mmHg @ 25 °C
Flash Point TCC Value 93.33 °C TCC
logP (o/w) 3.486 est
Solubility
alcohol Yes
water, 21.05 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Floral
fresh, watery, floral, cyclamen, sweet
Odor strength medium , recommend smelling in a 10.00 % solution or less
Substantivity 104 hour(s) at 100.00 %
Luebke, William tgsc, (1986) At 10.00 % in dipropylene glycol. fresh watery floral cyclamen sweet
Bourgeonal is a powerful, diffusive fresh floral muguet, with a watery green character. Its unique muguet-aldehyde character is extensively used in toiletries and alcoholic fragrances. Floral, Green, Muguet, Fresh, Powerful
General comment Fresh, strong-floral, muguet-note, watery

Potential Uses

Applications
Odor purposes Aldehydic, Cyclamen, Floral, Green, Lily, Lily of the valley, Orange blossom
Cosmetic purposes Perfuming agents

Safety Information

Safety information

European information :
Most important hazard(s):
Xn - Harmful.
R 22 - Harmful if swallowed.
R 36/37/38 - Irritating to eyes, respiratory system, and skin.
S 02 - Keep out of the reach of children.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36/37/39 - Wear suitable clothing, gloves and eye/face protection.
Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
Pictogram
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
oral-rat LD50 2700 mg/kg
Food and Chemical Toxicology. Vol. 26, Pg. 287, 1988.

Dermal Toxicity:
skin-rabbit LDLo 5000 mg/kg
Food and Chemical Toxicology. Vol. 26, Pg. 287, 1988.

Inhalation Toxicity:
Not determined

Safety in use information

Category:
fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
IFRA Critical Effect:
Dermal sensitization and systemic toxicity
IFRA fragrance material specification:
Should not be used such that the level in the finished cosmetic product exceeds 0.6%. Based on test results showing sensitising potential and no sensitisation reactions when tested at 6%. (IFRA guidelines).
View the IFRA Standard
View IFRA Standards Library for complete information.
Please review Amendment 49 IFRA documentation for complete information.
IFRA RESTRICTION LIMITS IN THE FINISHED PRODUCT (%):
Category 1: Products applied to the lips
0.0041 %
Category 2: Products applied to the axillae
0.025 %
Category 3: Products applied to the face/body using fingertips
0.025 %
Category 4: Products related to fine fragrance
0.47 %
Category 5: Products applied to the face and body using the hands (palms), primarily leave-on
Category 5A: Body lotion products applied to the body using the hands (palms), primarily leave-on
0.12 %
Category 5B: Face moisturizer products applied to the face using the hands (palms), primarily leave-on
0.029 %
Category 5C: Hand cream products applied to the hands using the hands (palms), primarily leave-on
0.037 %
Category 5D: Baby Creams, baby Oils and baby talc
0.0096 %
Category 6: Products with oral and lip exposure
0.087 %
Category 7: Products applied to the hair with some hand contact
Category 7A: Rinse-off products applied to the hair with some hand contact
0.029 %
Category 7B: Leave-on products applied to the hair with some hand contact
0.029 %
Category 8: Products with significant anogenital exposure
0.0096 %
Category 9: Products with body and hand exposure, primarily rinse off
0.099 %
Category 10: Household care products with mostly hand contact
Category 10A: Household care excluding aerosol products (excluding aerosol/spray products)
0.099 %
Category 10B: Household aerosol/spray products
0.24 %
Category 11: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate
Category 11A: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
0.0096 %
Category 11B: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
0.0096 %
Category 12: Products not intended for direct skin contact, minimal or insignificant transfer to skin
6.90 %
Notes:
IFRA FLAVOR REQUIREMENTS:

Due to the possible ingestion of small amounts of fragrance ingredients from their use in products in Categories 1 and 6, materials must not only comply with IFRA Standards but must also be recognized as safe as a flavoring ingredient as defined by the IOFI Code of Practice (www.iofi.org). For more details see chapter 1 of the Guidance for the use of IFRA Standards.

Recommendation for cyclamen propanal flavor usage levels up to:
not for flavor use.

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):18127-01-0
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :64832
National Institute of Allergy and Infectious Diseases:Data
SCCNFP:opinion
WGK Germany:2
3-(4-tert-butylphenyl)propanal
Chemidplus:0018127010