Home Sulfos 4-Bromo-1-[(4-methylbenzene)sulfonyl]pyrazole

4-Bromo-1-[(4-methylbenzene)sulfonyl]pyrazole

CAS No.:
116228-41-2
Catalog Number:
AG000BZ9
Molecular Formula:
C10H9BrN2O2S
Molecular Weight:
301.1597
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$94
- +
5g
98%
In Stock USA
United States
$350
- +
25g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG000BZ9
Chemical Name:
4-Bromo-1-[(4-methylbenzene)sulfonyl]pyrazole
CAS Number:
116228-41-2
Molecular Formula:
C10H9BrN2O2S
Molecular Weight:
301.1597
MDL Number:
MFCD06080375
IUPAC Name:
4-bromo-1-(4-methylphenyl)sulfonylpyrazole
InChI:
InChI=1S/C10H9BrN2O2S/c1-8-2-4-10(5-3-8)16(14,15)13-7-9(11)6-12-13/h2-7H,1H3
InChI Key:
XRKOINRPMVFMFN-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)n1ncc(c1)Br
Properties
Complexity:
333  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.957g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.158g/mol
Monoisotopic Mass:
299.957g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties