Home Halogens Methyl 2-bromomethyl-5-nitrobenzoate

Methyl 2-bromomethyl-5-nitrobenzoate

CAS No.:
90725-68-1
Catalog Number:
AG00GS6K
Molecular Formula:
C9H8BrNO4
Molecular Weight:
274.0681
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$107
- +
5g
98%
In Stock USA
United States
$332
- +
10g
98%
In Stock USA
United States
$532
- +
25g
98%
In Stock USA
United States
$1000
- +
Product Description
Catalog Number:
AG00GS6K
Chemical Name:
Methyl 2-bromomethyl-5-nitrobenzoate
CAS Number:
90725-68-1
Molecular Formula:
C9H8BrNO4
Molecular Weight:
274.0681
MDL Number:
MFCD04114313
IUPAC Name:
methyl 2-(bromomethyl)-5-nitrobenzoate
InChI:
InChI=1S/C9H8BrNO4/c1-15-9(12)8-4-7(11(13)14)3-2-6(8)5-10/h2-4H,5H2,1H3
InChI Key:
OAEABYNRBPCSQB-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(ccc1CBr)[N+](=O)[O-]
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.964g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.07g/mol
Monoisotopic Mass:
272.964g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties