Home Sulfos 1-(2-methoxyethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride

1-(2-methoxyethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride

CAS No.:
1183972-27-1
Catalog Number:
AG01ACVJ
Molecular Formula:
C8H13ClN2O3S
Molecular Weight:
252.7184
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Product Description
Catalog Number:
AG01ACVJ
Chemical Name:
1-(2-methoxyethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride
CAS Number:
1183972-27-1
Molecular Formula:
C8H13ClN2O3S
Molecular Weight:
252.7184
MDL Number:
MFCD12403823
IUPAC Name:
1-(2-methoxyethyl)-3,5-dimethylpyrazole-4-sulfonyl chloride
InChI:
InChI=1S/C8H13ClN2O3S/c1-6-8(15(9,12)13)7(2)11(10-6)4-5-14-3/h4-5H2,1-3H3
InChI Key:
MPAOKWAEHWIBKZ-UHFFFAOYSA-N
SMILES:
COCCn1nc(c(c1C)S(=O)(=O)Cl)C
Properties
Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.034g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.713g/mol
Monoisotopic Mass:
252.034g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties