Home Other Building Blocks 3,4-DIMETHOXYTHIOPHENE-2-CARBOXYLIC ACID

3,4-DIMETHOXYTHIOPHENE-2-CARBOXYLIC ACID

CAS No.:
113589-62-1
Catalog Number:
AG01DUZO
Molecular Formula:
C7H8O4S
Molecular Weight:
188.2010
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Product Description
Catalog Number:
AG01DUZO
Chemical Name:
3,4-DIMETHOXYTHIOPHENE-2-CARBOXYLIC ACID
CAS Number:
113589-62-1
Molecular Formula:
C7H8O4S
Molecular Weight:
188.2010
MDL Number:
MFCD20645208
IUPAC Name:
3,4-dimethoxythiophene-2-carboxylic acid
InChI:
InChI=1S/C7H8O4S/c1-10-4-3-12-6(7(8)9)5(4)11-2/h3H,1-2H3,(H,8,9)
InChI Key:
TYTHJHBOCYLVCY-UHFFFAOYSA-N
SMILES:
COc1c(OC)csc1C(=O)O
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.014g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.197g/mol
Monoisotopic Mass:
188.014g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
84A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties