Home Sulfos 2-Bromo-1-methanesulfonyl-4-nitrobenzene

2-Bromo-1-methanesulfonyl-4-nitrobenzene

CAS No.:
180297-54-5
Catalog Number:
AG00AQHN
Molecular Formula:
C7H6BrNO4S
Molecular Weight:
280.0958
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$188
- +
5g
98%
In Stock USA
United States
$700
- +
Product Description
Catalog Number:
AG00AQHN
Chemical Name:
2-Bromo-1-methanesulfonyl-4-nitrobenzene
CAS Number:
180297-54-5
Molecular Formula:
C7H6BrNO4S
Molecular Weight:
280.0958
MDL Number:
MFCD23135929
IUPAC Name:
2-bromo-1-methylsulfonyl-4-nitrobenzene
InChI:
InChI=1S/C7H6BrNO4S/c1-14(12,13)7-3-2-5(9(10)11)4-6(7)8/h2-4H,1H3
InChI Key:
RKUAFVBITZRKPS-UHFFFAOYSA-N
SMILES:
Brc1cc(ccc1S(=O)(=O)C)[N+](=O)[O-]
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.92g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.092g/mol
Monoisotopic Mass:
278.92g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties