8.16125
Benzyl butyrate
for synthesis
Synonym(s):
Benzyl butyrate
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About This Item
Empirical Formula (Hill Notation):
C11H14O2
CAS Number:
Molecular Weight:
178.23
UNSPSC Code:
12352108
EC Index Number:
203-105-1
NACRES:
NA.22
MDL number:
vapor pressure
11.97 hPa ( 109 °C)
Quality Level
assay
≥98.0% (GC)
form
liquid
potency
2330 mg/kg LD50, oral (Rat), >5000 mg/kg LD50, skin (Rabbit)
bp
235-242 °C/1013 hPa
transition temp
flash point 107 °C
density
1.01 g/cm3
storage temp.
2-30°C
SMILES string
O(Cc1ccccc1)C(=O)CCC
InChI
1S/C11H14O2/c1-2-6-11(12)13-9-10-7-4-3-5-8-10/h3-5,7-8H,2,6,9H2,1H3
InChI key
VONGZNXBKCOUHB-UHFFFAOYSA-N
Analysis Note
Assay (GC, area%): ≥ 98.0 % (a/a)
Density (d 20 °C/ 4 °C): 1.005 - 1.010
Identity (IR): passes test
Density (d 20 °C/ 4 °C): 1.005 - 1.010
Identity (IR): passes test
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Storage Class
10 - Combustible liquids
wgk
WGK 2
flash_point_f
224.6 °F - closed cup
flash_point_c
107 °C - closed cup
Certificates of Analysis (COA)
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