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Home Carbonyls Methyl 2-(4-methoxycarbonyl-2-nitrophenyl)acetate

Methyl 2-(4-methoxycarbonyl-2-nitrophenyl)acetate

CAS No.:
334952-07-7
Catalog Number:
AG0039BL
Molecular Formula:
C11H11NO6
Molecular Weight:
253.2081
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$63
- +
1g
98%
In Stock USA
United States
$144
- +
5g
98%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG0039BL
Chemical Name:
Methyl 2-(4-methoxycarbonyl-2-nitrophenyl)acetate
CAS Number:
334952-07-7
Molecular Formula:
C11H11NO6
Molecular Weight:
253.2081
MDL Number:
MFCD18207133
IUPAC Name:
methyl 4-(2-methoxy-2-oxoethyl)-3-nitrobenzoate
InChI:
InChI=1S/C11H11NO6/c1-17-10(13)6-7-3-4-8(11(14)18-2)5-9(7)12(15)16/h3-5H,6H2,1-2H3
InChI Key:
DCDSLKRPXTVJSA-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1ccc(cc1[N+](=O)[O-])C(=O)OC
Properties
Complexity:
337  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.059g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.21g/mol
Monoisotopic Mass:
253.059g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
98.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties