Home Sulfos 4-(1,3-dioxolan-2-yl)-1-methyl-1H-pyrazole-5-sulfonyl chloride

4-(1,3-dioxolan-2-yl)-1-methyl-1H-pyrazole-5-sulfonyl chloride

CAS No.:
2137987-99-4
Catalog Number:
AG01EIW3
Molecular Formula:
C7H9ClN2O4S
Molecular Weight:
252.6754
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Product Description
Catalog Number:
AG01EIW3
Chemical Name:
4-(1,3-dioxolan-2-yl)-1-methyl-1H-pyrazole-5-sulfonyl chloride
CAS Number:
2137987-99-4
Molecular Formula:
C7H9ClN2O4S
Molecular Weight:
252.6754
MDL Number:
MFCD31433964
IUPAC Name:
4-(1,3-dioxolan-2-yl)-2-methylpyrazole-3-sulfonyl chloride
InChI:
InChI=1S/C7H9ClN2O4S/c1-10-6(15(8,11)12)5(4-9-10)7-13-2-3-14-7/h4,7H,2-3H2,1H3
InChI Key:
GBYBIHURTMOMGW-UHFFFAOYSA-N
SMILES:
Cn1ncc(c1S(=O)(=O)Cl)C1OCCO1
Properties
Complexity:
324  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.997g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.669g/mol
Monoisotopic Mass:
251.997g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties