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经验公式(希尔记法):
C9H6O6 · xH2O
化学文摘社编号:
分子量:
210.14 (anhydrous basis)
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
MDL number:
Beilstein/REAXYS Number:
2214816
Assay:
≥98.0% (calc. based on dry substance, T)
Form:
solid
InChI
1S/C9H6O6/c10-7(11)4-2-1-3-5(8(12)13)6(4)9(14)15/h1-3H,(H,10,11)(H,12,13)(H,14,15)
SMILES string
OC(=O)c1cccc(C(O)=O)c1C(O)=O
InChI key
UJMDYLWCYJJYMO-UHFFFAOYSA-N
assay
≥98.0% (calc. based on dry substance, T)
form
solid
mp
~195 °C (dec.)
functional group
carboxylic acid
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Analysis Note
最高可含 2mol 水
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
存储类别
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
Crystal structure of hemimellitic acid dihydrate (1, 2, 3-benzenetricarboxylic acid dihydrate).
Mo F and Adman E.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials, 31(1), 192-198 (1975)
Derivatives of Hemimellitic Acid. A Synthesis of Erythrocentaurin1.
Wenkert E, et al.
The Journal of Organic Chemistry, 29(9), 2534-2542 (1964)
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