428558
5-(4-Nitrophenyl)-2-furoic acid
96%
Synonym(s):
5-(4-Nitrophenyl)-2-furancarboxylic acid
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About This Item
Empirical Formula (Hill Notation):
C11H7NO5
CAS Number:
Molecular Weight:
233.18
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
96%
InChI
1S/C11H7NO5/c13-11(14)10-6-5-9(17-10)7-1-3-8(4-2-7)12(15)16/h1-6H,(H,13,14)
SMILES string
OC(=O)c1ccc(o1)-c2ccc(cc2)[N+]([O-])=O
InChI key
FXZTYDPWMQBTDH-UHFFFAOYSA-N
assay
96%
mp
255-257 °C (dec.) (lit.)
functional group
carboxylic acid, nitro
Quality Level
General description
5-(4-Nitrophenyl)-2-furoic acid (5-(p-nitrophenyl)-2-furoic acid) is a 5-aryl-2-furoic acid. It is a dantrolene metabolite and its presence in plasma and urine has been determined by HPLC. It was reported to be the only product formed during the reduction of 5-(4-nitrophenyl)-2-furaldehyde by modified Cannizzaro reaction.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
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Determination of a dantrolene metabolite, 5-(p-nitrophenyl)-2-furoic acid, in plasma and urine by high-performance liquid chromatography.
E W Wuis et al.
Journal of chromatography, 526(2), 575-580 (1990-04-06)
Furan derivatives. XXX. preparation of substituted 5-phenyl-2-furfuryl alcohols.
Frimm RAK and Kovac J.
Chemical Papers, 26, 551-556 (1972)
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