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About This Item
Linear Formula:
CH3(CH2)4COCH3
CAS Number:
Molecular Weight:
114.19
UNSPSC Code:
12352115
EC Index Number:
203-767-1
NACRES:
NA.22
MDL number:
Assay:
≥98% (GC)
Grade:
synthesis grade
Bp:
150-152 °C/1013 hPa
Vapor pressure:
4.5 hPa ( 20 °C)
grade
synthesis grade
Quality Level
vapor pressure
4.5 hPa ( 20 °C)
assay
≥98% (GC)
form
liquid
autoignition temp.
305 °C
potency
1670 mg/kg LD50, oral (Rat), 10332 mg/kg LD50, skin (Rabbit)
expl. lim.
1.11-7.9 % (v/v)
dilution
(for synthesis)
bp
150-152 °C/1013 hPa
mp
-35 °C
transition temp
flash point 43 °C
solubility
4.3 g/L
density
0.82 g/cm3 at 20 °C
storage temp.
2-30°C
SMILES string
O=C(CCCCC)C
InChI
1S/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3
InChI key
CATSNJVOTSVZJV-UHFFFAOYSA-N
Analysis Note
Assay (GC, area%): ≥ 98.0 % (a/a)
Density (d 20 °C/ 4 °C): 0.814 - 0.816
Identity (IR): passes test
Density (d 20 °C/ 4 °C): 0.814 - 0.816
Identity (IR): passes test
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signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Flam. Liq. 3
Storage Class
3 - Flammable liquids
wgk
WGK 1
flash_point_f
105.8 °F - closed cup
flash_point_c
41 °C - closed cup
Certificates of Analysis (COA)
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