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About This Item
Empirical Formula (Hill Notation):
C12H18O7 · H2O
CAS Number:
Molecular Weight:
292.28
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352106
MDL number:
Quality Segment
assay
98%
optical activity
[α]21/D −20°, c = 2 in methanol
mp
88-90 °C (lit.)
storage temp.
2-8°C
SMILES string
[H]O[H].CC1(C)OC[C@@H]2O[C@]3(OC(C)(C)O[C@H]3[C@@H]2O1)C(O)=O
InChI
1S/C12H18O7.H2O/c1-10(2)15-5-6-7(17-10)8-12(16-6,9(13)14)19-11(3,4)18-8;/h6-8H,5H2,1-4H3,(H,13,14);1H2/t6-,7+,8-,12+;/m0./s1
InChI key
ZFQRGFMVXLSLKZ-QCILGFJPSA-N
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
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