Home Sulfos 2-methyl-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-3-thiophenesulfonyl chloride

2-methyl-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-3-thiophenesulfonyl chloride

CAS No.:
1287752-72-0
Catalog Number:
AG00J2I1
Molecular Formula:
C9H6ClF3N2O2S2
Molecular Weight:
330.7343
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG00J2I1
Chemical Name:
2-methyl-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-3-thiophenesulfonyl chloride
CAS Number:
1287752-72-0
Molecular Formula:
C9H6ClF3N2O2S2
Molecular Weight:
330.7343
MDL Number:
MFCD20502900
IUPAC Name:
2-methyl-5-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiophene-3-sulfonyl chloride
InChI:
InChI=1S/C9H6ClF3N2O2S2/c1-4-7(19(10,16)17)3-6(18-4)5-2-8(15-14-5)9(11,12)13/h2-3H,1H3,(H,14,15)
InChI Key:
ZTYVPQJIYIFDSJ-UHFFFAOYSA-N
SMILES:
Cc1sc(cc1S(=O)(=O)Cl)c1n[nH]c(c1)C(F)(F)F
Properties
Complexity:
440  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.951g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
330.724g/mol
Monoisotopic Mass:
329.951g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
99.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties