00483
Isobutyl acetoacetate
≥98.0% (GC)
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About This Item
Linear Formula:
CH3COCH2COOCH2CH(CH3)3
CAS Number:
Molecular Weight:
158.19
PubChem Substance ID:
eCl@ss:
39022304
UNSPSC Code:
12352100
NACRES:
NA.22
EC Number:
231-937-5
MDL number:
Beilstein/REAXYS Number:
1761405
Product Name
Isobutyl acetoacetate, ≥98.0% (GC)
SMILES string
CC(C)COC(=O)CC(C)=O
CC(C)COC(=O)CC(C)=O
InChI key
ZYXNLVMBIHVDRH-UHFFFAOYSA-N
InChI
1S/C8H14O3/c1-6(2)5-11-8(10)4-7(3)9/h6H,4-5H2,1-3H3
assay
≥98.0% (GC)
form
liquid
refractive index
n20/D 1.424 (lit.)
n20/D 1.424
bp
100 °C/22 mmHg (lit.)
density
0.98 g/mL at 25 °C (lit.)
functional group
ester
ketone
Quality Level
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Disclaimer
may discolor to yellow on storage
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
172.4 °F - closed cup
flash_point_c
78 °C - closed cup
ppe
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
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