Home Halogens Methyl 4,5-dichloro-3-hydroxythiophene-2-carboxylate

Methyl 4,5-dichloro-3-hydroxythiophene-2-carboxylate

CAS No.:
96232-70-1
Catalog Number:
AG005VBZ
Molecular Formula:
C6H4Cl2O3S
Molecular Weight:
227.0652
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
500mg
95%
In Stock USA
United States
$453
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Product Description
Catalog Number:
AG005VBZ
Chemical Name:
Methyl 4,5-dichloro-3-hydroxythiophene-2-carboxylate
CAS Number:
96232-70-1
Molecular Formula:
C6H4Cl2O3S
Molecular Weight:
227.0652
MDL Number:
MFCD15071695
IUPAC Name:
methyl 4,5-dichloro-3-hydroxythiophene-2-carboxylate
InChI:
InChI=1S/C6H4Cl2O3S/c1-11-6(10)4-3(9)2(7)5(8)12-4/h9H,1H3
InChI Key:
OKYOKWYLOLTNFT-UHFFFAOYSA-N
SMILES:
COC(=O)c1sc(c(c1O)Cl)Cl
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.926g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.055g/mol
Monoisotopic Mass:
225.926g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties