Home Other Building Blocks 1005613-94-4
1005613-94-4,MFCD04968668
Catalog No.:AA00029G
1005613-94-4 | 1,5-Dimethyl-1h-pyrazole-4-sulfonyl chloride
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Purity
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Price(USD)
Quantity
  
1g
95%
in stock  
$223.00   $156.00
- +
5g
95%
in stock  
$731.00   $512.00
- +
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Technical Information
Catalog Number:
AA00029G
Chemical Name:
1,5-Dimethyl-1h-pyrazole-4-sulfonyl chloride
CAS Number:
1005613-94-4
Molecular Formula:
C5H7ClN2O2S
Molecular Weight:
194.6393
MDL Number:
MFCD04968668
IUPAC Name:
1,5-dimethylpyrazole-4-sulfonyl chloride
InChI:
InChI=1S/C5H7ClN2O2S/c1-4-5(11(6,9)10)3-7-8(4)2/h3H,1-2H3
InChI Key:
UYNDJYIYDFTXCG-UHFFFAOYSA-N
SMILES:
Cn1ncc(c1C)S(=O)(=O)Cl
Properties
Computed Properties
 
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.992g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.633g/mol
Monoisotopic Mass:
193.992g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

Synonyms
 
1,5-dimethyl-1H-pyrazole-4-sulfonyl chloride 
1005613-94-4 
MFCD04968668 
SBB021605 
STK312912 
AKOS000306988 
ZINC100147719 
FS-4923 
MCULE-1559675125 
RTR-033776 
(1,5-dimethylpyrazol-4-yl)chlorosulfone 
TR-033776 
1,5-dimethylpyrazole-4-sulfonyl chloride 
FT-0677973 
Y-1440 
1H-Pyrazole-4-sulfonyl chloride, 1,5-dimethyl- 
1,5-DIMETHYL-1H-PYRAZOLE-4-SULFONYLCHLORIDE 
I14-27099 
1,5-Dimethyl-1H-pyrazole-4-sulfonyl chloride, AldrichCPR 
C5H7ClN2O2S 
SCHEMBL1501094 
CTK3J9072 
DTXSID80588679 
UYNDJYIYDFTXCG-UHFFFAOYSA-N 
ALBB-000996 
7195AC 
BBL013068 
Literature
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