94560
Methyl valerate
analytical standard
Synonym(s):
Methyl pentanoate
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About This Item
Linear Formula:
CH3(CH2)3CO2CH3
CAS Number:
Molecular Weight:
116.16
UNSPSC Code:
85151701
NACRES:
NA.24
PubChem Substance ID:
EC Number:
210-838-0
Beilstein/REAXYS Number:
1741905
MDL number:
grade
analytical standard
Quality Level
assay
≥99.8% (GC)
shelf life
limited shelf life, expiry date on the label
technique(s)
HPLC: suitable, gas chromatography (GC): suitable
refractive index
n20/D 1.397 (lit.), n20/D 1.398
bp
128 °C (lit.)
density
0.875 g/mL at 25 °C (lit.)
application(s)
cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care
format
neat
SMILES string
CCCCC(=O)OC
InChI
1S/C6H12O2/c1-3-4-5-6(7)8-2/h3-5H2,1-2H3
InChI key
HNBDRPTVWVGKBR-UHFFFAOYSA-N
General description
Methyl valerate is a methyl ester, which may find application as a surrogate component in the production of biodiesel.
Application
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.
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signalword
Warning
hcodes
Hazard Classifications
Flam. Liq. 3 - Skin Sens. 1B
Storage Class
3 - Flammable liquids
wgk
WGK 2
flash_point_f
84.2 °F
flash_point_c
29 °C
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
危险化学品
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Experiments and modeling of the autoignition of methyl pentanoate at low to intermediate temperatures and elevated pressures in a rapid compression machine
Weber.WB, et al.
Fuel: The Science and Technology of Fuel and Energy, 212, 479-486 (2018)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 94560-5ML | 04061833295724 |
| 94560-1ML | 04061837240263 |