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

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

CAS No.:
1253225-69-2
Catalog Number:
AG01B6MF
Molecular Formula:
C7H7ClO5S
Molecular Weight:
238.6455
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Product Description
Catalog Number:
AG01B6MF
Chemical Name:
methyl 5-(chlorosulfonyl)-3-methylfuran-2-carboxylate
CAS Number:
1253225-69-2
Molecular Formula:
C7H7ClO5S
Molecular Weight:
238.6455
MDL Number:
MFCD22190814
IUPAC Name:
methyl 5-chlorosulfonyl-3-methylfuran-2-carboxylate
InChI:
InChI=1S/C7H7ClO5S/c1-4-3-5(14(8,10)11)13-6(4)7(9)12-2/h3H,1-2H3
InChI Key:
HEXWEIMKHZBKHP-UHFFFAOYSA-N
SMILES:
COC(=O)c1oc(cc1C)S(=O)(=O)Cl
Properties
Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.97g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.638g/mol
Monoisotopic Mass:
237.97g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
82A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties