Home Sulfos 3-(2,4-dichloro-5-fluorophenyl)-1H-pyrazole-4-sulfonyl chloride

3-(2,4-dichloro-5-fluorophenyl)-1H-pyrazole-4-sulfonyl chloride

CAS No.:
1293000-27-7
Catalog Number:
AG01AF89
Molecular Formula:
C9H4Cl3FN2O2S
Molecular Weight:
329.5627
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Product Description
Catalog Number:
AG01AF89
Chemical Name:
3-(2,4-dichloro-5-fluorophenyl)-1H-pyrazole-4-sulfonyl chloride
CAS Number:
1293000-27-7
Molecular Formula:
C9H4Cl3FN2O2S
Molecular Weight:
329.5627
MDL Number:
MFCD13480651
IUPAC Name:
5-(2,4-dichloro-5-fluorophenyl)-1H-pyrazole-4-sulfonyl chloride
InChI:
InChI=1S/C9H4Cl3FN2O2S/c10-5-2-6(11)7(13)1-4(5)9-8(3-14-15-9)18(12,16)17/h1-3H,(H,14,15)
InChI Key:
GPDOVQVGLDDSES-UHFFFAOYSA-N
SMILES:
Clc1cc(Cl)c(cc1c1n[nH]cc1S(=O)(=O)Cl)F
Properties
Complexity:
405  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.904g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
329.551g/mol
Monoisotopic Mass:
327.904g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
71.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties