Home Sulfos methyl 4-bromo-5-(chlorosulfonyl)thiophene-2-carboxylate

methyl 4-bromo-5-(chlorosulfonyl)thiophene-2-carboxylate

CAS No.:
1306606-67-6
Catalog Number:
AG01AIJE
Molecular Formula:
C6H4BrClO4S2
Molecular Weight:
319.5806
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Product Description
Catalog Number:
AG01AIJE
Chemical Name:
methyl 4-bromo-5-(chlorosulfonyl)thiophene-2-carboxylate
CAS Number:
1306606-67-6
Molecular Formula:
C6H4BrClO4S2
Molecular Weight:
319.5806
MDL Number:
MFCD18839111
IUPAC Name:
methyl 4-bromo-5-chlorosulfonylthiophene-2-carboxylate
InChI:
InChI=1S/C6H4BrClO4S2/c1-12-5(9)4-2-3(7)6(13-4)14(8,10)11/h2H,1H3
InChI Key:
IRAYQSPTRMDCHJ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(c(s1)S(=O)(=O)Cl)Br
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.842g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.568g/mol
Monoisotopic Mass:
317.842g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
97.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties