Synonym
3-Methyl-2-nitrophenol
IUPAC/Chemical Name
3-Methyl-2-nitrophenol
InChi Key
QIORDSKCCHRSSD-UHFFFAOYSA-N
InChi Code
InChI=1S/C7H7NO3/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4,9H,1H3
SMILES Code
OC1=CC=CC(C)=C1[N+]([O-])=O
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>3 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
Preparing Stock Solutions
The following data is based on the
product
molecular weight
153.14
Batch specific molecular weights may vary
from batch to batch
due to the degree of hydration, which will
affect the solvent
volumes required to prepare stock solutions.
| Concentration / Solvent Volume / Mass |
1 mg |
5 mg |
10 mg |
| 1 mM |
1.15 mL |
5.76 mL |
11.51 mL |
| 5 mM |
0.23 mL |
1.15 mL |
2.3 mL |
| 10 mM |
0.12 mL |
0.58 mL |
1.15 mL |
| 50 mM |
0.02 mL |
0.12 mL |
0.23 mL |
1: Olariu RI, Barnes I, Bejan I, Arsene C, Vione D, Klotz B, Becker KH. FT-IR
product study of the reactions of NO3 radicals with ortho-, meta-, and
para-cresol. Environ Sci Technol. 2013 Jul 16;47(14):7729-38. doi:
10.1021/es401096w. Epub 2013 Jun 28. PubMed PMID: 23751015.
2: Mahadevan D, Periandy S, Karabacak M, Ramalingam S, Puviarasan N.
Spectroscopic (FT-IR, FT-Raman and UV-vis) investigation and frontier molecular
orbitals analysis on 3-methyl-2-nitrophenol using hybrid computational
calculations. Spectrochim Acta A Mol Biomol Spectrosc. 2012 Feb;86:139-51. doi:
10.1016/j.saa.2011.10.020. Epub 2011 Oct 19. PubMed PMID: 22074882.
3: Chen J, Wenger JC, Venables DS. Near-ultraviolet absorption cross sections of
nitrophenols and their potential influence on tropospheric oxidation capacity. J
Phys Chem A. 2011 Nov 10;115(44):12235-42. doi: 10.1021/jp206929r. Epub 2011 Oct
14. PubMed PMID: 21958133.
4: Bejan I, Barnes I, Olariu R, Zhou S, Wiesen P, Benter T. Investigations on the
gas-phase photolysis and OH radical kinetics of methyl-2-nitrophenols. Phys Chem
Chem Phys. 2007 Nov 14;9(42):5686-92. Epub 2007 Sep 7. PubMed PMID: 17960257.
5: Morville S, Scheyer A, Mirabel P, Millet M. Spatial and geographical
variations of urban, suburban and rural atmospheric concentrations of phenols and
nitrophenols. Environ Sci Pollut Res Int. 2006 Mar;13(2):83-9. PubMed PMID:
16612896.
6: Mulder GJ, van Doorn AB. A rapid NAD+-linked assay for microsomal uridine
diphosphate glucuronyltransferase of rat liver and some observations on substrate
specificity of the enzyme. Biochem J. 1975 Oct;151(1):131-40. PubMed PMID:
174550; PubMed Central PMCID: PMC1172334.
