Home Halogens 2-Thiophenecarboxylic acid, 4,5-dichloro-3-methoxy-

2-Thiophenecarboxylic acid, 4,5-dichloro-3-methoxy-

CAS No.:
120715-49-3
Catalog Number:
AG00HFP2
Molecular Formula:
C6H4Cl2O3S
Molecular Weight:
227.0652
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Product Description
Catalog Number:
AG00HFP2
Chemical Name:
2-Thiophenecarboxylic acid, 4,5-dichloro-3-methoxy-
CAS Number:
120715-49-3
Molecular Formula:
C6H4Cl2O3S
Molecular Weight:
227.0652
MDL Number:
MFCD26129600
IUPAC Name:
4,5-dichloro-3-methoxythiophene-2-carboxylic acid
InChI:
InChI=1S/C6H4Cl2O3S/c1-11-3-2(7)5(8)12-4(3)6(9)10/h1H3,(H,9,10)
InChI Key:
GSUFOPYPKUVCQB-UHFFFAOYSA-N
SMILES:
COc1c(sc(c1Cl)Cl)C(=O)O
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  
Properties