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About This Item
Empirical Formula (Hill Notation):
C9H11BrN2O6
CAS Number:
Molecular Weight:
323.10
UNSPSC Code:
12352204
NACRES:
NA.22
PubChem Substance ID:
EC Number:
213-486-6
Beilstein/REAXYS Number:
33664
MDL number:
Assay:
98%
Form:
crystals
Storage temp.:
−20°C
Quality Segment
assay
98%
form
crystals
optical activity
[α]22/D −11°, c = 2 in H2O
mp
180-182 °C (dec.) (lit.)
storage temp.
−20°C
SMILES string
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=C(Br)C(=O)NC2=O
InChI
1S/C9H11BrN2O6/c10-3-1-12(9(17)11-7(3)16)8-6(15)5(14)4(2-13)18-8/h1,4-6,8,13-15H,2H2,(H,11,16,17)/t4-,5-,6-,8-/m1/s1
InChI key
AGFIRQJZCNVMCW-UAKXSSHOSA-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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