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3740-52-1 | 2-(2-Nitrophenyl)acetic acid
CAS No: 3740-52-1 Catalog No: AG003HSX MDL No:MFCD00007190
Product Description
Catalog Number:
AG003HSX
Chemical Name:
2-(2-Nitrophenyl)acetic acid
CAS Number:
3740-52-1
Molecular Formula:
C8H7NO4
Molecular Weight:
181.1455
MDL Number:
MFCD00007190
IUPAC Name:
2-(2-nitrophenyl)acetic acid
InChI:
InChI=1S/C8H7NO4/c10-8(11)5-6-3-1-2-4-7(6)9(12)13/h1-4H,5H2,(H,10,11)
InChI Key:
WMUZDBZPDLHUMW-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccccc1[N+](=O)[O-]
EC Number:
223-128-0
UNII:
05TN0SUY38
NSC Number:
16624
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.038g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.147g/mol
Monoisotopic Mass:
181.038g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| Inhibition of human carboxylesterases hCE1 and hiCE by cholinesterase inhibitors. | Chemico-biological interactions 20130325 |
| Molecular mechanism of uncaging CO2 from nitrophenylacetate provides general guidelines for improved ortho-nitrobenzyl cages. | Chemphyschem : a European journal of chemical physics and physical chemistry 20110801 |
| (2-Nitrophenyl)acetyl: a new, selectively removable hydroxyl protecting group. | Organic letters 20100507 |
| Total synthesis of (+/-)- and (-)-actinophyllic acid. | Journal of the American Chemical Society 20100407 |
| Delta9-tetrahydrocannabinol is a full agonist at CB1 receptors on GABA neuron axon terminals in the hippocampus. | Neuropharmacology 20100101 |
| The α,5-dicarboxy-2-nitrobenzyl caging group, a tool for biophysical applications with improved hydrophilicity: synthesis, photochemical properties and biological characterization. | Photochemistry and photobiology 20100101 |
| Leveraging a small-molecule modification to enable the photoactivation of rho GTPases. | Chembiochem : a European journal of chemical biology 20091214 |
| 5-(3-Nitro-benz-yl)-1,3,4-thia-diazol-2-amine. | Acta crystallographica. Section E, Structure reports online 20091201 |
| Competition between cleavage and decarboxylation in photolysis of alpha-carboxy-2-nitrobenzyl protected cysteine derivatives. | Chemical communications (Cambridge, England) 20090614 |
| Studies of decarboxylation in photolysis of alpha-carboxy-2-nitrobenzyl (CNB) caged compounds. | Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20080101 |
| Mechanisms of cholinesterase inhibition by inorganic mercury. | The FEBS journal 20070401 |
| Comparative analysis of inhibitory effects of caged ligands for the NMDA receptor. | Journal of neuroscience methods 20050315 |
| Synthesis and characterization of photolabile o-nitrobenzyl derivatives of urea. | The Journal of organic chemistry 20021213 |
| Studies on the catalytic behaviour of a cholinesterase-like abzyme in an AOT microemulsion system. | Journal of biotechnology 20020807 |
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