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645087

5-Phenylisoxazole-3-carboxylic acid

Name: 5-Phenylisoxazole-3-carboxylic acid
Brand: ALDRICH

97%

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About This Item

Empirical Formula (Hill Notation):

C₁₀H₇NO₃

CAS Number:

14441-90-8

Molecular Weight:

189.17

NACRES:

NA.22

PubChem Substance ID:

24883373

UNSPSC Code:

12352100

MDL number:

MFCD00464221

Assay:

97%

Form:

solid

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Properties

Quality Level

100

assay

97%

form

solid

mp

160-164 °C (lit.)

functional group

carboxylic acid, phenyl

SMILES string

OC(=O)c1cc(on1)-c2ccccc2

InChI

1S/C10H7NO3/c12-10(13)8-6-9(14-11-8)7-4-2-1-3-5-7/h1-6H,(H,12,13)

InChI key

XJYOBHXWBRKOQO-UHFFFAOYSA-N

Description

pictograms

GHS08,GHS07

signalword

Danger

hcodes

H302,H315,H317,H319,H334,H335

pcodes

P280 - P301 + P312 + P330 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 2

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Faceshields, Gloves

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Analytical studies on isoxazoles. II A new fluorimetric determination of 5-phenyl-3-isoxazolecarboxylic acid and its application to the determination of perisoxal in plasma.

T Umeda et al.

Chemical & pharmaceutical bulletin, 28(12), 3507-3513 (1980-12-01)

Rational design of 5-phenyl-3-isoxazolecarboxylic acid ethyl esters as growth inhibitors of Mycobacterium tuberculosis. a potent and selective series for further drug development.

Annamaria Lilienkampf et al.

Journal of medicinal chemistry, 53(2), 678-688 (2009-12-17)

New antituberculosis (anti-TB) drugs are urgently needed to shorten the 6-12 month treatment regimen and especially to battle drug-resistant Mycobacterium tuberculosis (Mtb) strains. In this study, we have continued our efforts to develop isoxazole-based anti-TB compounds by applying rational drug

Global Trade Item Number

SKU	GTIN
645087-5G	04061833357286
645087-1G	04061826698556