Home Halogens Methyl 2-(bromomethyl)-5-chloro-4-nitrobenzoate

Methyl 2-(bromomethyl)-5-chloro-4-nitrobenzoate

CAS No.:
1441173-02-9
Catalog Number:
AG00HX1E
Molecular Formula:
C9H7BrClNO4
Molecular Weight:
308.5132
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$727
- +
1g
95%
1 week
United States
$1763
- +
Product Description
Catalog Number:
AG00HX1E
Chemical Name:
Methyl 2-(bromomethyl)-5-chloro-4-nitrobenzoate
CAS Number:
1441173-02-9
Molecular Formula:
C9H7BrClNO4
Molecular Weight:
308.5132
MDL Number:
MFCD26407235
IUPAC Name:
methyl 2-(bromomethyl)-5-chloro-4-nitrobenzoate
InChI:
InChI=1S/C9H7BrClNO4/c1-16-9(13)6-3-7(11)8(12(14)15)2-5(6)4-10/h2-3H,4H2,1H3
InChI Key:
YZZYBIJGZZQMPH-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Cl)c(cc1CBr)[N+](=O)[O-]
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.925g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.512g/mol
Monoisotopic Mass:
306.925g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties