8.14500
Isoamyl benzoate
for synthesis
Synonym(s):
Isoamyl benzoate, Benzoic acid isoamyl ester
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About This Item
Empirical Formula (Hill Notation):
C12H16O2
CAS Number:
Molecular Weight:
192.25
UNSPSC Code:
12352108
EC Index Number:
202-334-4
NACRES:
NA.22
MDL number:
Assay:
≥99.0% (GC)
Form:
liquid
Quality Level
assay
≥99.0% (GC)
form
liquid
potency
6330 mg/kg LD50, oral (Rat)
bp
260 °C
transition temp
flash point 89 °C
density
0.99 g/cm3 at 20 °C
storage temp.
2-30°C
SMILES string
O(CCC(C)C)C(=O)c1ccccc1
InChI
1S/C12H16O2/c1-10(2)8-9-14-12(13)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChI key
MLLAPOCBLWUFAP-UHFFFAOYSA-N
Analysis Note
Assay (GC, area%): ≥ 99.0 % (a/a)
Density (d 20 °C/ 4 °C): 0.988 - 0.990
Identity (IR): passes test
Density (d 20 °C/ 4 °C): 0.988 - 0.990
Identity (IR): passes test
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Storage Class
10 - Combustible liquids
wgk
WGK 2
flash_point_f
Not applicable
flash_point_c
Not applicable
Certificates of Analysis (COA)
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