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W288500

Sigma-Aldrich

3-Phenyl-1-propanol

≥98%, FCC

Synonym(s):

3-Phenylpropyl alcohol, Hydrocinnamyl alcohol

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About This Item

Linear Formula:
C6H5(CH2)3OH
CAS Number:
122-97-4
Molecular Weight:
136.19
FEMA Number:
2885
Beilstein/REAXYS Number:
1857542
EC Number:
204-587-6
Council of Europe no.:
80
MDL number:
MFCD00002950
UNSPSC Code:
12164502
PubChem Substance ID:
24901373
Flavis number:
2.031
NACRES:
NA.21

biological source

synthetic

agency

meets purity specifications of JECFA

reg. compliance

FCC
FDA 21 CFR 172.515

assay

≥98%

refractive index

n20/D 1.526 (lit.)

bp

119-121 °C/12 mmHg (lit.)

mp

−18 °C (lit.)

density

1.001 g/mL at 20 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

organoleptic

balsam; cinnamon; hyacinth; floral; spicy

SMILES string

OCCCc1ccccc1

InChI

1S/C9H12O/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2

InChI key

VAJVDSVGBWFCLW-UHFFFAOYSA-N

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General description

3-Phenyl-1-propanol is a volatile compound that is reported to occur in styrax gum, guava fruit, and beeswax.

Application

Preservative in cosmetics - This alcohol a natural fragrance with antimicrobial properties against bacteria and molds. It is used in combination with Heliotropin or Piperonal as a preservative for cosmetic products.
This alcohol or its ester derivatives are used as fragrance component in fresh flower compositions, like lilac, hyacinth, and lily of the valley because of the balsamic odor character.

Disclaimer

For R&D or non-EU Food use. Not for retail sale.

pictograms

Corrosion
GHS05

signalword

Danger

hcodes

H314

Hazard Classifications

Eye Dam. 1 - Skin Corr. 1B

Storage Class

8A - Combustible corrosive hazardous materials

wgk_germany

WGK 3

flash_point_f

248.0 °F - closed cup

flash_point_c

120 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Chemical composition of the essential oil and headspace solid-phase microextraction of the guava fruit (Psidium guajava L.).
Paniandy JC, et al.
J. Essent. Oil Res., 12(2), 153-158 (2000)
The aroma of beeswax.
Ferber CE & Nursten HE
Journal of the Science of Food and Agriculture, 28(6), 511-518 (1977)
Chemical composition of the essential oils from Turkish and Honduras Styrax.
Fernandez X, et al.
Flavour and Fragrance Journal, 20(1), 70-73 (2005)
D Belsito et al.
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association, 49 Suppl 2, S256-S267 (2011-08-09)
The cinnamyl phenylpropyl fragrance ingredients are a diverse group of chemical structures that have similar metabolic and toxicity profiles. A toxicological and dermatological review of these fragrance ingredients is presented. The common characteristic structural element of cinnamyl phenylpropyl materials is
Jörgen Samuelsson et al.
Journal of chromatography. A, 1217(46), 7215-7221 (2010-10-12)
The elution by characteristic points (ECP) method is a very rapid and precise method for determination of the phase system equilibrium of phase systems in broad solute concentration ranges. Thus, the method is especially suitable for rapid characterization of high
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