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7780-14-5

7780-14-5 | 2-Nitrophenyl hexanoate

CAS No: 7780-14-5 Catalog No: AG005RQK MDL No:

Product Description

Catalog Number:
AG005RQK
Chemical Name:
2-Nitrophenyl hexanoate
CAS Number:
7780-14-5
Molecular Formula:
C12H15NO4
Molecular Weight:
237.2518
IUPAC Name:
(4-nitrophenyl) hexanoate
InChI:
InChI=1S/C12H15NO4/c1-2-3-4-5-12(14)17-11-8-6-10(7-9-11)13(15)16/h6-9H,2-5H2,1H3
InChI Key:
OLRXUEYZKCCEKK-UHFFFAOYSA-N
SMILES:
CCCCCC(=O)Oc1ccccc1[N+](=O)[O-]

Properties

Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.1g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.255g/mol
Monoisotopic Mass:
237.1g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

Literature

Title Journal
A thermostable esterase from Thermoanaerobacter tengcongensis opening up a new family of bacterial lipolytic enzymes. Biochimica et biophysica acta 20111201
A novel family VII esterase with industrial potential from compost metagenomic library. Microbial cell factories 20110101
Hydrolysis of p-nitrophenyl esters promoted by semifluorinated quaternary ammonium polymer latexes and films. Langmuir : the ACS journal of surfaces and colloids 20101019
A novel esterase Sso2518 from Sulfolobus solfataricus with a much lower temperature optimum than the growth temperature. Biotechnology letters 20100801
Diversity of polyester-degrading bacteria in compost and molecular analysis of a thermoactive esterase from Thermobifida alba AHK119. Applied microbiology and biotechnology 20100601
Characterization of a novel esterase Rv0045c from Mycobacterium tuberculosis. PloS one 20100101
Hydrolysis of p-nitrophenyl esters in mixtures of water and a fluorous solvent. Langmuir : the ACS journal of surfaces and colloids 20090409
Gene cloning and characterization of a novel esterase from activated sludge metagenome. Microbial cell factories 20090101
SSoNDelta and SSoNDeltalong: two thermostable esterases from the same ORF in the archaeon Sulfolobus solfataricus? Archaea (Vancouver, B.C.) 20070501
A novel esterase from Ralstonia sp. M1: gene cloning, sequencing, high-level expression and characterization. Protein expression and purification 20070201
Effect of counterions on the activity of lipase in cationic water-in-oil microemulsions. Langmuir : the ACS journal of surfaces and colloids 20061010
Non-covalent modification of the heme-pocket of apomyoglobin by a 1,10-phenanthroline derivative. Bioorganic & medicinal chemistry letters 20060115
Effect of heteroatom insertion at the side chain of 5-alkyl-1H-tetrazoles on their properties as catalysts for ester hydrolysis at neutral pH. The Journal of organic chemistry 20051125
Ester cleavage properties of synthetic hydroxybenzotriazoles in cationic monovalent and gemini surfactant micelles. Langmuir : the ACS journal of surfaces and colloids 20050104
Computational study on hydroxybenzotriazoles as reagents for ester hydrolysis. The Journal of organic chemistry 20041210
Catalysis by hydrophobically modified poly(propylenimine) dendrimers having quaternary ammonium and tertiary amine functionality. Langmuir : the ACS journal of surfaces and colloids 20040914
Sequence-based approach to finding functional lipases from microbial genome databases. FEMS microbiology letters 20040615
Quantification of intra- and extra-cellular thermophilic lipase/esterase production by Thermus sp. Biotechnology letters 20040501
Molecular cloning and characterization of two thermostable carboxyl esterases from Geobacillus stearothermophilus. Gene 20040331
A substrate-induced switch in the reaction mechanism of a thermophilic esterase: kinetic evidences and structural basis. The Journal of biological chemistry 20040220
Synthesis of new Cu(II)-chelating ligand amphiphiles and their esterolytic properties in cationic micelles. The Journal of organic chemistry 20030404

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