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General Material Information

Preferred name dihydrosafrole
Trivial Name Dihydrosafrole
Short Description 1-(3,4-methylenedioxyphenyl)propane
Formula C10 H12 O2
CAS Number 94-58-6
ECHA Number 202-344-9
FDA UNII 2ML63PLH7G
Nikkaji Number J15.552G
Beilstein Number 0131188
MDL MFCD00022999
Bio Activity Summary External link
NMR Predictor External link
Synonyms
  • benzene, 1,2-(methylenedioxy)-4-propyl-
  • benzene, 1,2-methylenedioxy-4-propyl-
  • 1,3-benzodioxole, 5-propyl-
  • dihydrosafrol
  • 2',3'- dihydrosafrole
  • 1,2-methylenedioxy-4-propyl benzene
  • [1,2-( methylenedioxy)-4-propyl]benzene
  • 1,2-( methylenedioxy)-4-propylbenzene
  • 1-(3,4-methylenedioxyphenyl)propane
  • 4-propyl-1,2-(methylenedioxy)benzene
  • 4-propyl-1,2-methylenedioxybenzene
  • 5-propyl-1,3-benzodioxole
  • safrole, dihydro-
  • 5-propyl-1,3-benzodioxole
  • 1,3-Benzodioxole, 5-propyl-
  • 1,2-(Methylenedioxy)-4-propylbenzene
  • 2′,3′-Dihydrosafrole
  • 5-Propylbenz[1,3]dioxole
  • NSC 27867
  • NSC 33707

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

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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
CHEBI:View
KEGG (GenomeNet):C19229
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2932.99.6550
ChemSpider:View
Wikipedia:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 164.20404052734
Specific gravity @ 25 °C
Pounds per Gallon 8.845 to 8.903
Refractive Index 1.517 to 1.52 @ 20 °C
Flash Point TCC Value 99.3 °C TCC
logP (o/w) 3.587 est
Solubility
alcohol Yes
water, 56.87 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Spicy
spicy, sassafrass
General comment At 10.00 % in dipropylene glycol. spicy sassafrass

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.
Human Experience:
12 % solution: no irritation or sensitization.
Oral/Parenteral Toxicity:
oral-rat LD50 2260 mg/kg
Toxicology and Applied Pharmacology. Vol. 7, Pg. 18, 1965.

oral-mouse LD50 3700 mg/kg
Toxicology and Applied Pharmacology. Vol. 7, Pg. 18, 1965.

intraperitoneal-mouse LD50 2830 mg/kg
Comptes Rendus Hebdomadaires des Seances, Academie des Sciences. Vol. 250, Pg. 1148, 1960.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 12, Pg. 527, 1974.

Inhalation Toxicity:
Not determined

Safety in use information

Category:
information only not used for fragrances or flavors
IFRA Critical Effect:
Carcinogenicity
IFRA fragrance material specification:
Safrole as such should not be used as a fragrance ingredient; essential oils containing safrole should not be used at a level such that the total concentration of safrole exceeds 0.01% in consumer products. Examples of essential oils with a high safrole content are Sassafras oil (Sassafras officinale Nees& Eberm.), Ocotea Cymbarum oil (Ocotea pretiosa Metz) and certain qualities of Camphor oils. The total concentration of safrole, isosafrole and dihydrosafrole should not exceed 0.01% in consumer products. These recommendations are based on the conclusions of the Scientific Committee on Cosmetology of the EEC on safrole and on the similarity of the biological activity of these substances (Scientific Committee of Cosmetology of the EEC, opinion reached on September 2, 1980; Communication to the EEC Commission ENV/521/79 and IARC Monograph Vol. 10, 1976, 231-244).
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
See notebox %
Category 2: Products applied to the axillae
See notebox %
Category 3: Products applied to the face/body using fingertips
See notebox %
Category 4: Products related to fine fragrance
See notebox %
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
See notebox %
Category 5B: Face moisturizer products applied to the face using the hands (palms), primarily leave-on
See notebox %
Category 5C: Hand cream products applied to the hands using the hands (palms), primarily leave-on
See notebox %
Category 5D: Baby Creams, baby Oils and baby talc
See notebox %
Category 6: Products with oral and lip exposure
See notebox %
Category 7: Products applied to the hair with some hand contact
Category 7A: Rinse-off products applied to the hair with some hand contact
See notebox %
Category 7B: Leave-on products applied to the hair with some hand contact
See notebox %
Category 8: Products with significant anogenital exposure
See notebox %
Category 9: Products with body and hand exposure, primarily rinse off
See notebox %
Category 10: Household care products with mostly hand contact
Category 10A: Household care excluding aerosol products (excluding aerosol/spray products)
See notebox %
Category 10B: Household aerosol/spray products
See notebox %
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
See notebox %
Category 11B: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
See notebox %
Category 12: Products not intended for direct skin contact, minimal or insignificant transfer to skin
See notebox
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.

Fragrance ingredient restriction - Note box
On the basis of established maximum concentration levels of this substance in commercially available natural sources (like essential oils, extracts and absolutes), exposure to this substance from the use of these oils and extracts is regarded acceptable as long as the total concentration of Safrole, Isosafrole and Dihydrosafrole in the finished consumer pro duct doesnot exceed 0.01%.
Recommendation for dihydrosafrole flavor usage levels up to:
not for flavor use.

Safety references

EPI System: View
Chemical Carcinogenesis Research Information System:Search
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
Carcinogenic Potency Database:Search
EPA GENetic TOXicology:Search
EPA Substance Registry Services (TSCA):94-58-6
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :7197
National Institute of Allergy and Infectious Diseases:Data
5-propyl-1,3-benzodioxole
Chemidplus:0000094586
EPA/NOAA CAMEO:hazardous materials