8.20638
Methyl hexanoate
for synthesis
Synonym(s):
Methyl hexanoate, Methyl caproate, Caproic acid methyl ester, Hexanoic acid methyl ester
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About This Item
Linear Formula:
CH3(CH2)4COOCH3
CAS Number:
Molecular Weight:
130.18
UNSPSC Code:
12352108
EC Index Number:
203-425-1
NACRES:
NA.22
MDL number:
Assay:
≥98.0% (GC)
Form:
liquid
vapor pressure
3.7 hPa ( 20 °C)
Quality Level
assay
≥98.0% (GC)
form
liquid
potency
>5000 mg/kg LD50, oral (Rat)
bp
151 °C/1013 hPa
mp
-71 °C
transition temp
flash point 41 °C
density
0.88 g/cm3 at 20 °C
storage temp.
2-30°C
SMILES string
O(C)C(=O)CCCCC
InChI
1S/C7H14O2/c1-3-4-5-6-7(8)9-2/h3-6H2,1-2H3
InChI key
NUKZAGXMHTUAFE-UHFFFAOYSA-N
Analysis Note
Assay (GC, area%): ≥ 98.0 % (a/a)
Density (d 20 °C/ 4 °C): 0.884 - 0.885
Identity (IR): passes test
Density (d 20 °C/ 4 °C): 0.884 - 0.885
Identity (IR): passes test
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signalword
Warning
hcodes
Hazard Classifications
Flam. Liq. 3
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
99.5 °F - closed cup
flash_point_c
37.5 °C - closed cup
Regulatory Information
危险化学品
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Global Trade Item Number
| SKU | GTIN |
|---|---|
| 8206380005 | 04022536463346 |
| 8206380250 | 04022536463353 |