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About This Item
Empirical Formula (Hill Notation):
C10H14O4
CAS Number:
Molecular Weight:
198.22
UNSPSC Code:
12352100
PubChem Substance ID:
MDL number:
Assay:
98%
InChI
1S/C10H14O4/c1-3-14-10(13)9-6(2)4-7(11)5-8(9)12/h5-6,9,11H,3-4H2,1-2H3
SMILES string
CCOC(=O)C1C(C)CC(O)=CC1=O
InChI key
GABAYOQGPJPKDK-UHFFFAOYSA-N
assay
98%
mp
91-93 °C (lit.)
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Determination of mass spectral and fragmentation pattern of some centrally-acting 1, 3-cyclohexandione derivatives.
Ogunleye DS.
Nigerian Journal of Pharmaceutical Research, 3(1), 72-81 (2005)
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