Home Halogens t-Butyl 4-bromo-2-nitrobenzoate

t-Butyl 4-bromo-2-nitrobenzoate

CAS No.:
890315-72-7
Catalog Number:
AG0042C7
Molecular Formula:
C11H12BrNO4
Molecular Weight:
302.1213
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$19
- +
5g
98%
In Stock USA
United States
$63
- +
10g
98%
In Stock USA
United States
$113
- +
25g
98%
In Stock USA
United States
$275
- +
100g
98%
In Stock USA
United States
$813
- +
Product Description
Catalog Number:
AG0042C7
Chemical Name:
t-Butyl 4-bromo-2-nitrobenzoate
CAS Number:
890315-72-7
Molecular Formula:
C11H12BrNO4
Molecular Weight:
302.1213
MDL Number:
MFCD00191313
IUPAC Name:
tert-butyl 4-bromo-2-nitrobenzoate
InChI:
InChI=1S/C11H12BrNO4/c1-11(2,3)17-10(14)8-5-4-7(12)6-9(8)13(15)16/h4-6H,1-3H3
InChI Key:
WFQHGCOHRFRRHU-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)[N+](=O)[O-])C(=O)OC(C)(C)C
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.995g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.124g/mol
Monoisotopic Mass:
300.995g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties