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Home Nitros Ethyl 2-(2-nitrophenoxy)acetate

Ethyl 2-(2-nitrophenoxy)acetate

CAS No.:
37682-31-8
Catalog Number:
AG00I7FE
Molecular Formula:
C10H11NO5
Molecular Weight:
225.1980
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$110
- +
5g
96%
In Stock USA
United States
$360
- +
Product Description
Catalog Number:
AG00I7FE
Chemical Name:
Ethyl 2-(2-nitrophenoxy)acetate
CAS Number:
37682-31-8
Molecular Formula:
C10H11NO5
Molecular Weight:
225.1980
MDL Number:
MFCD00100679
IUPAC Name:
ethyl 2-(2-nitrophenoxy)acetate
InChI:
InChI=1S/C10H11NO5/c1-2-15-10(12)7-16-9-6-4-3-5-8(9)11(13)14/h3-6H,2,7H2,1H3
InChI Key:
ULWPSRBTOBHBKT-UHFFFAOYSA-N
SMILES:
CCOC(=O)COc1ccccc1[N+](=O)[O-]
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.064g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.2g/mol
Monoisotopic Mass:
225.064g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Study of the role played by NfsA, NfsB nitroreductase and NemA flavin reductase from Escherichia coli in the conversion of ethyl 2-(2'-nitrophenoxy)acetate to 4-hydroxy-(2H)-1,4-benzoxazin-3(4H)-one (D-DIBOA), a benzohydroxamic acid with interesting biological properties. Applied microbiology and biotechnology 20120401
Properties