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About This Item
Linear Formula:
HOC6H3(NO2)CH2OH
CAS Number:
Molecular Weight:
169.13
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Assay
98%
mp
123-127 °C (lit.)
functional group
hydroxyl
nitro
SMILES string
OCc1cc(ccc1O)[N+]([O-])=O
InChI
1S/C7H7NO4/c9-4-5-3-6(8(11)12)1-2-7(5)10/h1-3,9-10H,4H2
InChI key
JEIYIXDNZKATLC-UHFFFAOYSA-N
General description
2-Hydroxy-5-nitrobenzyl alcohol (HNB) can be synthesized from dimethyl(2-hydroxyl-5-nitrobenzyl)sulfonium bromide. Its crystal structure has been analyzed. The interaction of HNB with glutathione S-transferases (GSTs) at tryptophan residues has been investigated.
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
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