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muguet butanol

Chemical Structure

General Material Information

Preferred name muguet butanol
Trivial Name α,β-Dimethylbenzenepropanol
Short Description muguesia (IFF)
Formula C11 H16 O
CAS Number 56836-93-2
ECHA Number 260-398-9
FDA UNII Search
Nikkaji Number J267.113A
xLogP3-AA 2.70 (est)
NMR Predictor External link
Synonyms
  • alpha,beta- dimethyl benzene propanol
  • 3-methyl-4-phenyl 2-butanol
  • 3-methyl-4-phenyl butan-2-ol
  • 3-methyl-4-phenyl-2-butanol
  • 3-methyl-4-phenylbutan-2-ol
  • muguesia (IFF)
  • starfleur 40 (IFF)
  • 3-methyl-4-phenylbutan-2-ol
  • Benzenepropanol, α,β-dimethyl-
  • 2-Butanol, 3-methyl-4-phenyl-
  • α,β-Dimethylbenzenepropanol
  • Muguesia
  • 3-Methyl-4-phenyl-2-butanol

US / EU / FDA / JECFA / FEMA / Scholar / Patents

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Literature & References

Leffingwell:Chirality or Article
3-methyl-4-phenylbutan-2-ol
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):92543
Pubchem (sid):135048334
Publications by PubMed
[Study on inhibitory effect of different extract fractions from longdan xiegan decoction on biofilms of Candida albicans].
Chemical and antimicrobial evaluation of supercritical and conventional Sideritis scardica Griseb., Lamiaceae extracts.
Chirality and fragrance chemistry: stereoisomers of the commercial chiral odorants Muguesia and Pamplefleur.
In vitro and in vivo activities of syn2836, syn2869, syn2903, and syn2921: new series of triazole antifungal agents.
New azole antifungals. 2. Synthesis and antifungal activity of heterocyclecarboxamide derivatives of 3-amino-2-aryl-1-azolyl-2-butanol.
Synthesis and antifungal activity of novel thiazole-containing triazole antifungals. II. Optically active ER-30346 and its derivatives.
Liposomes containing Candida albicans ribosomes as a prophylactic vaccine against disseminated candidiasis in mice.
Optically active antifungal azoles. V. Synthesis and antifungal activity of stereoisomers of 3-azolyl-2-(substituted phenyl)-1-(1H-1,2,4-triazol-1-yl)-2- butanols.
Optically active antifungal azoles. IV. Synthesis and antifungal activity of (2R,3R)-3-azolyl-2-(substituted phenyl)-1-(1H-1,2,4-triazol-1-yl)-2-butanols.
Optically active antifungal azoles. II. Synthesis and antifungal activity of polysulfide derivatives of (2R,3R)-2-(2,4-difluorophenyl)-3-mercapto-1-(1H- 1,2,4-triazol-1-yl)-2-butanol.
Optically active antifungal azoles. I. Synthesis and antifungal activity of (2R,3R)-2-(2,4-difluorophenyl)-3-mercapto-1-(1H-1,2,4-triazol-1-yl)-2-b utanol and its stereoisomers.
Triazole antifungals. V. Synthesis and antifungal activities of some amides related to 3-acylamino-2-aryl-1-triazolyl-2-butanol.
Xylocandin: a new complex of antifungal peptides. I. Taxonomy, isolation and biological activity.

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
HMDB (The Human Metabolome Database):Search
Export Tariff Code:29062920000
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 164.24772644043
Specific gravity @ 25 °C
Pounds per Gallon 8.063 to 8.13
Refractive Index 1.513 to 1.519 @ 20 °C
Boiling Point 256 to 257°C @ 760 mm Hg
Vapor Pressure 0.008 mmHg @ 25 °C
Flash Point TCC Value 100 °C TCC
logP (o/w) 2.615
Shelf life 36 months (or longer if stored properly.)
Storage notes Store in cool, dry place in tightly sealed containers, protected from heat and light.
Solubility
alcohol Yes
water, 716.5 mg/L @ 25 °C (est) Yes
water No
Stability
acid cleaner Unspecified
alcoholic lotion Unspecified
antiperspirant Unspecified
deo stick Unspecified
detergent Unspecified
fabric softener Unspecified
hard surface cleaner Unspecified
shampoo Unspecified
soap Unspecified

Organoleptic Properties

Odor Type: Floral
floral, muguet, green, rose, mentholic
Odor strength medium
Substantivity 137 hour(s) at 10.00 % in dipropylene glycol
Luebke, William tgsc, (2009) At 100.00 %. floral muguet green rose mentholic
General comment Floral muguet comes into its own where aldehydic muguet ingredients are not stable
Starfleur 40 rounds off green aldehydic muguet notes very well. A fresh, highly performing floral green, muguet, freesia, aldehydic note, with a natural transparent effect

Potential Uses

Applications
Odor purposes Aldehydic , Floral , Lily of the valley , Rose

Safety Information

Safety information

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:
Not determined
Dermal Toxicity:
Not determined
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
Recommendation for muguet butanol usage levels up to:
15.0000 % in the fragrance concentrate.
Recommendation for muguet butanol 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):56836-93-2
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :92543
National Institute of Allergy and Infectious Diseases:Data
3-methyl-4-phenylbutan-2-ol
Chemidplus:0056836932