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W273201

Sigma-Aldrich

2-Phenyl-1-propanol

≥97%, FG

Synonym(s):

(±)-2-Phenyl-1-propanol, β-Methylphenethyl alcohol

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About This Item

Linear Formula:
CH3CH(C6H5)CH2OH
CAS Number:
1123-85-9
Molecular Weight:
136.19
FEMA Number:
2732
Beilstein:
1906760
EC Number:
214-379-7
Council of Europe no.:
2257
MDL number:
MFCD00004736
UNSPSC Code:
12164502
PubChem Substance ID:
24901296
Flavis number:
2.073
NACRES:
NA.21

biological source

synthetic

Quality Level

400

grade

FG
Fragrance grade
Halal

Agency

follows IFRA guidelines

reg. compliance

EU Regulation 1223/2009
EU Regulation 1334/2008 & 872/2012

Assay

≥97%

refractive index

n20/D 1.526 (lit.)

bp

110-111 °C/10 mmHg (lit.)

density

0.975 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

Documentation

see Safety & Documentation for available documents

food allergen

no known allergens

fragrance allergen

no known allergens

Organoleptic

green; balsamic; spicy

SMILES string

CC(CO)c1ccccc1

InChI

1S/C9H12O/c1-8(7-10)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3

InChI key

RNDNSYIPLPAXAZ-UHFFFAOYSA-N

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Storage Class Code

10 - Combustible liquids

WGK

WGK 1

Flash Point(F)

201.2 °F - closed cup

Flash Point(C)

94 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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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W Gielsdorf et al.
Zeitschrift fur Rechtsmedizin. Journal of legal medicine, 89(3), 191-195 (1982-01-01)
The FAB (Fast Atom Bombardment)-mass spectrometric ionization technique, which has now been available for about 1 year, has been successfully employed in forensic toxicology. The mass spectral behaviour of some representative drug-glucuronides (Codeine, p-Nitrophenol and 2-Phenyl-1-propanol) were studied by positive-
I F Gaunt et al.
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association, 20(5), 519-525 (1982-10-01)
Phenylpropan-1-ol was added to the diet of groups of 15 male and 15 female rats to provide intakes of 0 (control), 10, 40 or 160 mg/kg/day for 13 wk. No effects on body weight, food intake, water intake, haematology, semi-quantitative
S Goenechea et al.
Zeitschrift fur Rechtsmedizin. Journal of legal medicine, 97(2), 83-88 (1986-01-01)
The behaviour of 2-phenyl-1-propanol (I) and 2-phenyl-2-propanol (II) and their glucuronides with HCl has been investigated. While I shows a high acidic constancy, II undergoes a partial conversion into 2-phenylpropane (III) which itself yields numerous products. The glucosidic bond of
K R Henne et al.
Biochemistry, 40(29), 8597-8605 (2001-07-18)
The active site topography of rabbit CYP4B1 has been studied relative to CYP2B1 and CYP102 using a variety of aromatic probe substrates. Oxidation of the prochiral substrate cumene by CYP4B1, but not CYP2B1 or CYP102, resulted in the formation of

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