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About This Item
Linear Formula:
(HO)3C6H2COCH3·H2O
CAS Number:
Molecular Weight:
186.16
PubChem Substance ID:
UNSPSC Code:
12352100
Beilstein/REAXYS Number:
9288656
MDL number:
SMILES string
O.CC(=O)c1c(O)cc(O)cc1O
InChI
1S/C8H8O4.H2O/c1-4(9)8-6(11)2-5(10)3-7(8)12;/h2-3,10-12H,1H3;1H2
InChI key
GDSIBPPJKSBCMF-UHFFFAOYSA-N
grade
purum
assay
≥99.0% (HPLC)
mp
218-222 °C, 219-221 °C (lit.)
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signalword
Warning
hcodes
pcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
13 - Non 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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