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3740-52-1,MFCD00007190
Catalog No.:AA003HQ5
3740-52-1 | 2-Nitrophenylacetic acid
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5g
98%
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$15.00   $10.00
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25g
98%
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$16.00   $11.00
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500g
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$286.00   $200.00
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  • Technical Information
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  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003HQ5
Chemical Name:
2-Nitrophenylacetic 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
Computed 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  

Synonyms
 
(2-nitrophenyl)acetic acid 
2-nitrophenylacetic acid 
(ortho-Nitrophenyl)acetic acid 
2-(o-Nitrophenyl)acetic acid 
2-Nitrobenzeneacetic acid 
UNII-05TN0SUY38 
MFCD00007190 
CCRIS 2336 
EINECS 223-128-0 
NSC 16624 
BRN 1959243 
(2-Nitro-phenyl)-acetic acid 
o-nitrophenylacetic acid 
AI3-31297 
05TN0SUY38 
WMUZDBZPDLHUMW-UHFFFAOYSA-N 
2-Nitrophenylacetic acid, 99% 
2-Nitro phenylacetic Acid 
PubChem9868 
AC1L2SUA 
o-nitrophenyl acetic acid 
2-nitrophenyl acetic acid 
orthonitrophenylacetic acid 
2-Nitrophenylacetic acid 
ACMC-1CR3A 
2-NITROPHENYLACETATE 
Cambridge id 5102607 
Benzeneaceticacid, 2-nitro- 
Oprea1_132121 
KSC222O5T 
ARONIS24102 
SCHEMBL124031 
AC1Q74V5 
Jsp006613 
3740-52-1 
2-Nitrophenylacetic acid, 98% 
DTXSID0063157 
CTK1C2759 
ZINC156503 
EBD21050 
KS-000046JC 
NSC16624 
STR03477 
ANW-28630 
BBL011770 
2-(2-nitrophenyl)acetic acid 
C2N825 
NSC-16624 
SBB028500 
STK411127 
AKOS000104760 
AN-6258 
CS-W019512 
MCULE-3522722427 
PS-4967 
RP24226 
o-Nitrophenylacetic acid 
RTR-036631 
TRA0086551 
VZ20065 
KS-0000053C 
AJ-13821 
AK-34908 
BR-34908 
LS-12615 
SC-03956 
SY002275 
(2-Nitrophenyl)acetic acid 
AB1003009 
DB-011082 
ST2416051 
TL8002750 
TR-036631 
AM20060243 
BB 0219319 
FT-0613208 
N0353 
ST45028997 
Benzeneacetic acid, 2-nitro- 
MFCD00007190 (98%) 
A24278 
M-6318 
W-106540 
F0051-0001 
null 
o-Nitrobenzeneacetic acid 
(o-Nitrophenyl)ethansaure 
C8H7NO4 
C8-H7-N-O4 
Acetic acid, (o-nitrophenyl)- 
CID77337 
ACN-040625 
4-09-00-01687 (Beilstein Handbook Reference) 
2-Nitrophenylacetic acid, 99% - 100G 100g 
C119971 
1099621-14-3 
Literature

Title: Inhibition of human carboxylesterases hCE1 and hiCE by cholinesterase inhibitors.

Journal: Chemico-biological interactions 20130325

Title: Molecular mechanism of uncaging CO2 from nitrophenylacetate provides general guidelines for improved ortho-nitrobenzyl cages.

Journal: Chemphyschem : a European journal of chemical physics and physical chemistry 20110801

Title: (2-Nitrophenyl)acetyl: a new, selectively removable hydroxyl protecting group.

Journal: Organic letters 20100507

Title: Total synthesis of (+/-)- and (-)-actinophyllic acid.

Journal: Journal of the American Chemical Society 20100407

Title: Delta9-tetrahydrocannabinol is a full agonist at CB1 receptors on GABA neuron axon terminals in the hippocampus.

Journal: Neuropharmacology 20100101

Title: The α,5-dicarboxy-2-nitrobenzyl caging group, a tool for biophysical applications with improved hydrophilicity: synthesis, photochemical properties and biological characterization.

Journal: Photochemistry and photobiology 20100101

Title: Leveraging a small-molecule modification to enable the photoactivation of rho GTPases.

Journal: Chembiochem : a European journal of chemical biology 20091214

Title: 5-(3-Nitro-benz-yl)-1,3,4-thia-diazol-2-amine.

Journal: Acta crystallographica. Section E, Structure reports online 20091201

Title: Competition between cleavage and decarboxylation in photolysis of alpha-carboxy-2-nitrobenzyl protected cysteine derivatives.

Journal: Chemical communications (Cambridge, England) 20090614

Title: Studies of decarboxylation in photolysis of alpha-carboxy-2-nitrobenzyl (CNB) caged compounds.

Journal: Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20080101

Title: Mechanisms of cholinesterase inhibition by inorganic mercury.

Journal: The FEBS journal 20070401

Title: Comparative analysis of inhibitory effects of caged ligands for the NMDA receptor.

Journal: Journal of neuroscience methods 20050315

Title: Synthesis and characterization of photolabile o-nitrobenzyl derivatives of urea.

Journal: The Journal of organic chemistry 20021213

Title: Studies on the catalytic behaviour of a cholinesterase-like abzyme in an AOT microemulsion system.

Journal: Journal of biotechnology 20020807

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