Home Sulfos 2-Furancarboxylic acid,5-(chlorosulfonyl)-, methyl ester

2-Furancarboxylic acid,5-(chlorosulfonyl)-, methyl ester

CAS No.:
69816-05-3
Catalog Number:
AG005TM4
Molecular Formula:
C6H5ClO5S
Molecular Weight:
224.6189
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Product Description
Catalog Number:
AG005TM4
Chemical Name:
2-Furancarboxylic acid,5-(chlorosulfonyl)-, methyl ester
CAS Number:
69816-05-3
Molecular Formula:
C6H5ClO5S
Molecular Weight:
224.6189
MDL Number:
MFCD02180740
IUPAC Name:
methyl 5-chlorosulfonylfuran-2-carboxylate
InChI:
InChI=1S/C6H5ClO5S/c1-11-6(8)4-2-3-5(12-4)13(7,9)10/h2-3H,1H3
InChI Key:
JYWNJCAFWPZETG-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(o1)S(=O)(=O)Cl
Properties
Complexity:
293  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.955g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.611g/mol
Monoisotopic Mass:
223.955g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
82A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties