Home Sulfos 1-Isopropyl-1H-pyrazole-5-sulfonyl chloride

1-Isopropyl-1H-pyrazole-5-sulfonyl chloride

CAS No.:
1174871-55-6
Catalog Number:
AG00J2O0
Molecular Formula:
C6H9ClN2O2S
Molecular Weight:
208.6659
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$358
- +
5g
95%
In Stock USA
United States
$1136
- +
Product Description
Catalog Number:
AG00J2O0
Chemical Name:
1-Isopropyl-1H-pyrazole-5-sulfonyl chloride
CAS Number:
1174871-55-6
Molecular Formula:
C6H9ClN2O2S
Molecular Weight:
208.6659
MDL Number:
MFCD12548039
IUPAC Name:
2-propan-2-ylpyrazole-3-sulfonyl chloride
InChI:
InChI=1S/C6H9ClN2O2S/c1-5(2)9-6(3-4-8-9)12(7,10)11/h3-5H,1-2H3
InChI Key:
APESRGNGHCTUQZ-UHFFFAOYSA-N
SMILES:
CC(n1nccc1S(=O)(=O)Cl)C
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.007g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.66g/mol
Monoisotopic Mass:
208.007g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties