MedKoo Cat#: 591940 | Name: p-Nitrophenylacetic acid
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Description:

WARNING: This product is for research use only, not for human or veterinary use.

p-Nitrophenylacetic acid is used in synthesis of fused azines.

Chemical Structure

p-Nitrophenylacetic acid
p-Nitrophenylacetic acid
CAS#104-03-0

Theoretical Analysis

MedKoo Cat#: 591940

Name: p-Nitrophenylacetic acid

CAS#: 104-03-0

Chemical Formula: C8H7NO4

Exact Mass: 181.0375

Molecular Weight: 181.15

Elemental Analysis: C, 53.04; H, 3.90; N, 7.73; O, 35.33

Price and Availability

Size Price Availability Quantity
25g USD 210.00
100g USD 370.00
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Synonym
p-Nitrophenylacetic acid; NSC 5398; NSC-5398; NSC5398
IUPAC/Chemical Name
4-Nitrophenylacetic acid
InChi Key
YBADLXQNJCMBKR-UHFFFAOYSA-N
InChi Code
InChI=1S/C8H7NO4/c10-8(11)5-6-1-3-7(4-2-6)9(12)13/h1-4H,5H2,(H,10,11)
SMILES Code
O=C(O)CC1=CC=C([N+]([O-])=O)C=C1
Appearance
Solid powder
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
2934.99.03.00
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 181.15 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.

Recalculate based on batch purity %
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: Ibrahim HM, Behbehani H. Synthesis of a new class of Pyridazin-3-one and 2-amino-5-arylazopyridine derivatives and their utility in the synthesis of fused azines. Molecules. 2014 Feb 24;19(2):2637-54. doi: 10.3390/molecules19022637. PubMed PMID: 24566327. 2: Ibrahim HM, Behbehani H, Makhseed S, Elnagdi MH. Acylation of heteroaromatic amines: facile and efficient synthesis of a new class of 1,2,3-triazolo[4,5-b]pyridine and pyrazolo[4,3-b]pyridine derivatives. Molecules. 2011 May 4;16(5):3723-39. doi: 10.3390/molecules16053723. PubMed PMID: 21544037. 3: Sakai H, Masada Y, Onuma H, Takeoka S, Tsuchida E. Reduction of methemoglobin via electron transfer from photoreduced flavin: restoration of O2-binding of concentrated hemoglobin solution coencapsulated in phospholipid vesicles. Bioconjug Chem. 2004 Sep-Oct;15(5):1037-45. PubMed PMID: 15366957. 4: Yang YL, Deng YH, Wang ST, Zong RF. [Synthesis, characterization and fluorescence property of europium ternary complex p-nitrophenylacetic acid and 1, 10-phenanthroline]. Guang Pu Xue Yu Guang Pu Fen Xi. 2001 Oct;21(5):680-1. Chinese. PubMed PMID: 12945330. 5: Wang ST, Nie FM, Yang YL, Deng YH, Zong RF, Hu QJ. [Synthesis and fluorescence property of complexes of rare-earth with p-nitrophenylacetic acid]. Guang Pu Xue Yu Guang Pu Fen Xi. 2002 Jun;22(3):412-3. Chinese. PubMed PMID: 12938319. 6: Saikachi H, Taniguchi Y. [Studies on thiophene derivatives. V. On the reaction of thiophene aldehydes with p-nitrophenylacetic acid]. Yakugaku Zasshi. 1968 Aug;88(8):1054-61. Japanese. PubMed PMID: 5751461.