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About This Item
Linear Formula:
(CH3)2CHCH2CH2OH
CAS Number:
Molecular Weight:
88.15
UNSPSC Code:
41116107
NACRES:
NA.24
PubChem Substance ID:
EC Number:
204-633-5
Beilstein/REAXYS Number:
1718835
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
impurities
≤0.1% 2-methylbutanol (remarks in GC)
refractive index
n20/D 1.407
bp
131-132 °C
density
0.809 g/mL at 20 °C (lit.)
application(s)
environmental
format
neat
SMILES string
CC(C)CCO
InChI
1S/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3
InChI key
PHTQWCKDNZKARW-UHFFFAOYSA-N
General description
3-Methylbutanol belongs to the group of high chain alcohols produced as metabolites from the degradation of amino acids via keto acids. It is a volatile flavor compound, highly present in alcoholic beverages.
Application
3-Methylbutanol may also be used as an analytical reference standard for the quantification of the analyte in liquor samples and milk samples using chromatography techniques.
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.
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signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 4 Inhalation - Eye Dam. 1 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
3 - Flammable liquids
wgk
WGK 1
flash_point_f
110.3 °F - closed cup
flash_point_c
43.5 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
危险化学品
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Aroma perception of individual volatile compounds in fresh tomatoes (Lycopersicon esculentum, Mill.) as affected by the medium of evaluation
Tandon.S.K, et al.
Journal of Solution Chemistry, 20(3), 261-268 (2000)
Flavours and Fragrances: Chemistry, Bioprocessing and Sustainability, 88(11), 3764-3772 (2007)
Quantitative determination of thermally derived off-flavor compounds in milk using solid-phase microextraction and gas chromatography
Vazquez-Landaverde A.P, et al.
Journal of Agricultural and Food Chemistry, 88(11), 3764-3772 (2005)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 59092-1ML | 04061832643533 |
| 59092-5ML | 04061832643540 |


