E49606
3-Ethyltoluene
99%
Synonym(s):
1-Ethyl-3-methylbenzene
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About This Item
Linear Formula:
C2H5C6H4CH3
CAS Number:
Molecular Weight:
120.19
Beilstein/REAXYS Number:
1850821
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
assay
99%
form
liquid
autoignition temp.
896 °F
refractive index
n20/D 1.496 (lit.)
bp
158-159 °C (lit.)
density
0.865 g/mL at 25 °C (lit.)
SMILES string
CCc1cccc(C)c1
InChI
1S/C9H12/c1-3-9-6-4-5-8(2)7-9/h4-7H,3H2,1-2H3
InChI key
ZLCSFXXPPANWQY-UHFFFAOYSA-N
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Application
3-Ethyltoluene is generally used as a model alkylbenzene derivative for bond activation and C(sp3)-H functionalization studies.
signalword
Warning
hcodes
Hazard Classifications
Flam. Liq. 3
Storage Class
3 - Flammable liquids
wgk_germany
WGK 3
flash_point_f
100.4 °F - closed cup
flash_point_c
38 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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