Home Sulfos 1-Bromo-4-methanesulfonyl-2,5-dimethylbenzene

1-Bromo-4-methanesulfonyl-2,5-dimethylbenzene

CAS No.:
1864063-77-3
Catalog Number:
AG00I1SQ
Molecular Formula:
C9H11BrO2S
Molecular Weight:
263.1514
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:
AG00I1SQ
Chemical Name:
1-Bromo-4-methanesulfonyl-2,5-dimethylbenzene
CAS Number:
1864063-77-3
Molecular Formula:
C9H11BrO2S
Molecular Weight:
263.1514
MDL Number:
MFCD29035425
IUPAC Name:
1-bromo-2,5-dimethyl-4-methylsulfonylbenzene
InChI:
InChI=1S/C9H11BrO2S/c1-6-5-9(13(3,11)12)7(2)4-8(6)10/h4-5H,1-3H3
InChI Key:
WVJBRAAANBGVCL-UHFFFAOYSA-N
SMILES:
Cc1cc(c(cc1Br)C)S(=O)(=O)C
Properties
Complexity:
268  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.966g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.149g/mol
Monoisotopic Mass:
261.966g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties