Home Halogens 5-bromo-4-methoxythiophene-2-carboxylic acid

5-bromo-4-methoxythiophene-2-carboxylic acid

CAS No.:
1423027-99-9
Catalog Number:
AG01A2WE
Molecular Formula:
C6H5BrO3S
Molecular Weight:
237.0711
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Product Description
Catalog Number:
AG01A2WE
Chemical Name:
5-bromo-4-methoxythiophene-2-carboxylic acid
CAS Number:
1423027-99-9
Molecular Formula:
C6H5BrO3S
Molecular Weight:
237.0711
MDL Number:
MFCD22628394
IUPAC Name:
5-bromo-4-methoxythiophene-2-carboxylic acid
InChI:
InChI=1S/C6H5BrO3S/c1-10-3-2-4(6(8)9)11-5(3)7/h2H,1H3,(H,8,9)
InChI Key:
SSZYFNWEXXZETP-UHFFFAOYSA-N
SMILES:
COc1cc(sc1Br)C(=O)O
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.914g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.067g/mol
Monoisotopic Mass:
235.914g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties