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About This Item
Empirical Formula (Hill Notation):
C7H14O2
CAS Number:
Molecular Weight:
130.18
UNSPSC Code:
12352112
EC Index Number:
219-376-4
NACRES:
NA.22
MDL number:
vapor pressure
5 hPa ( 20 °C)
Quality Segment
assay
≥94.0% (GC)
form
liquid
autoignition temp.
215 °C
potency
1660 mg/kg LD50, oral (Rat), 2520 mg/kg LD50, skin (Rabbit)
bp
163-165 °C/1013 mbar
transition temp
flash point 43 °C
density
0.92 g/cm3 at 20 °C
storage temp.
2-30°C
SMILES string
O1C(C1)COCCCC
InChI
1S/C7H14O2/c1-2-3-4-8-5-7-6-9-7/h7H,2-6H2,1H3
InChI key
YSUQLAYJZDEMOT-UHFFFAOYSA-N
Analysis Note
Assay (GC, area%): ≥ 94.0 % (a/a)
Density (d 20 °C/ 4 °C): 0.911 - 0.915
Peroxide (as H₂O₂): ≤ 0.005 %
Identity (IR): passes test
Density (d 20 °C/ 4 °C): 0.911 - 0.915
Peroxide (as H₂O₂): ≤ 0.005 %
Identity (IR): passes test
signalword
Warning
Hazard Classifications
Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Aquatic Chronic 3 - Carc. 2 - Flam. Liq. 3 - Muta. 2 - Repr. 2 - Skin Sens. 1 - STOT SE 3
target_organs
Respiratory system
Storage Class
3 - Flammable liquids
wgk
WGK 2
flash_point_f
129.2 °F - closed cup
flash_point_c
54 °C - closed cup
Certificates of Analysis (COA)
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