Home Carboxys 4,5-Dimethylthiophene-2-carboxylic acid

4,5-Dimethylthiophene-2-carboxylic acid

CAS No.:
40808-24-0
Catalog Number:
AG003KIG
Molecular Formula:
C7H8O2S
Molecular Weight:
156.2022
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Product Description
Catalog Number:
AG003KIG
Chemical Name:
4,5-Dimethylthiophene-2-carboxylic acid
CAS Number:
40808-24-0
Molecular Formula:
C7H8O2S
Molecular Weight:
156.2022
MDL Number:
MFCD00512748
IUPAC Name:
4,5-dimethylthiophene-2-carboxylic acid
InChI:
InChI=1S/C7H8O2S/c1-4-3-6(7(8)9)10-5(4)2/h3H,1-2H3,(H,8,9)
InChI Key:
RZCDKLUMNAKVFB-UHFFFAOYSA-N
SMILES:
OC(=O)c1sc(c(c1)C)C
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.025g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
156.199g/mol
Monoisotopic Mass:
156.025g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties