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About This Item
Linear Formula:
CH3OOCC6H4CH2CN
CAS Number:
Molecular Weight:
175.18
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
96%
Quality Level
assay
96%
bp
110 °C/0.2 mmHg (lit.)
mp
55-58 °C (lit.)
functional group
ester, nitrile
SMILES string
COC(=O)c1ccc(CC#N)cc1
InChI
1S/C10H9NO2/c1-13-10(12)9-4-2-8(3-5-9)6-7-11/h2-5H,6H2,1H3
InChI key
XRZGMNGGCZTNGE-UHFFFAOYSA-N
hcodes
pcodes
Hazard Classifications
Aquatic Chronic 3
Storage Class
10 - Combustible liquids
wgk
WGK 3
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Global Trade Item Number
| SKU | GTIN |
|---|---|
| 655597-5G | 04061831811506 |
| 655597-25G | 04061831822571 |