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Merck
CN

40858

Propyl acetate

analytical standard

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About This Item

Linear Formula:
CH3COOCH2CH2CH3
CAS Number:
109-60-4
Molecular Weight:
102.13
NACRES:
NA.24
PubChem Substance ID:
329756020
eCl@ss:
39022103
UNSPSC Code:
85151701
EC Number:
203-686-1
MDL number:
MFCD00009372
Beilstein/REAXYS Number:
1740764

Key Documents

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Product Name

Propyl acetate, analytical standard

InChI key

YKYONYBAUNKHLG-UHFFFAOYSA-N

InChI

1S/C5H10O2/c1-3-4-7-5(2)6/h3-4H2,1-2H3

SMILES string

CCCOC(C)=O

grade

analytical standard

vapor density

3.5 (vs air)

vapor pressure

25 mmHg ( 20 °C)

assay

≥99.7% (GC)

autoignition temp.

842 °F

shelf life

limited shelf life, expiry date on the label

expl. lim.

1.7 %, 37 °F
8 %

technique(s)

HPLC: suitable
gas chromatography (GC): suitable

refractive index

n20/D 1.384 (lit.)
n20/D 1.384

bp

102 °C (lit.)

mp

−95 °C (lit.)

solubility

water: soluble

density

0.888 g/mL at 25 °C (lit.)

application(s)

cleaning products
cosmetics
environmental
flavors and fragrances
food and beverages
personal care

format

neat

Quality Level

100

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Application

Propyl acetate may be used in the preparation of geranyl acetate.
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Other Notes

Find a digital Reference Material for this product available on our online platform ChemisTwin® for NMR. You can use this digital equivalent on ChemisTwin® for your sample identity confirmation and compound quantification (with digital external standard). An NMR spectrum of this substance can be viewed and an online comparison against your sample can be performed with a few mouseclicks. Learn more here and start your free trial.

pictograms

FlameExclamation mark
GHS02,GHS07

signalword

Danger

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 2 - STOT SE 3

target_organs

Central nervous system

supp_hazards

EUH066

Storage Class

3 - Flammable liquids

wgk

WGK 1

flash_point_f

53.2 °F - closed cup

flash_point_c

11.8 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

危险化学品
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Certificates of Analysis (COA)

Lot/Batch Number
BCCM7159
BCCK2892
BCCD7881
BCCD0369
BCBW2440

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Saturated vapour pressure of methyl acetate, ethyl acetate, n-propyl acetate, methyl propionate, and ethyl propionate.
Polak J and Mertl I
Collection of Czechoslovak Chemical Communications, 30, 3526-3528 (1965)
Excess molar enthalpies for binary mixtures of n-propanol, acetic acid, and n-propyl acetate at 313.15 K and atmospheric pressure.
Letyanina I, et al.
Fluid Phase Equilibria, 381, 77-82 (2014)
Kinetics study of propyl acetate synthesis reaction catalyzed by Amberlyst 15.
Huang YS and Sundmacher K.
International Journal of Chemical Kinetics, 39(5), 245-253 (2007)
Geranyl acetate synthesis by lipase-catalyzed transesterification in supercritical carbon dioxide.
Geranyl acetate synthesis by lipase-catalyzed transesterification in supercritical carbon dioxide.
Chulalaksananukul W, et al.
Enzyme and Microbial Technology, 15(8), 691-698 (1993)
S Puglisi-Allegra et al.
Pharmacology, biochemistry, and behavior, 13(2), 287-290 (1980-08-01)
An automated technique for measuring simultaneously aggressive behavior and motor activity in mice is described. This technique allows measure of aggressive behavior and motor activity continuously throughout long-lasting periods without disturbing the animals except for feeding, watering and cleaning the
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