Home Sulfos methyl 5-(chlorosulfonyl)-2-methylthiophene-3-carboxylate

methyl 5-(chlorosulfonyl)-2-methylthiophene-3-carboxylate

CAS No.:
2090072-28-7
Catalog Number:
AG01DW66
Molecular Formula:
C7H7ClO4S2
Molecular Weight:
254.7111
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Product Description
Catalog Number:
AG01DW66
Chemical Name:
methyl 5-(chlorosulfonyl)-2-methylthiophene-3-carboxylate
CAS Number:
2090072-28-7
Molecular Formula:
C7H7ClO4S2
Molecular Weight:
254.7111
MDL Number:
MFCD31629520
IUPAC Name:
methyl 5-chlorosulfonyl-2-methylthiophene-3-carboxylate
InChI:
InChI=1S/C7H7ClO4S2/c1-4-5(7(9)12-2)3-6(13-4)14(8,10)11/h3H,1-2H3
InChI Key:
ZGKOICVLGKINGF-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(sc1C)S(=O)(=O)Cl
Properties
Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.947g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.699g/mol
Monoisotopic Mass:
253.947g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
97.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties