Home Carboxys 5-(3-methylthiophen-2-yl)thiophene-2-carboxylic acid

5-(3-methylthiophen-2-yl)thiophene-2-carboxylic acid

CAS No.:
1342606-57-8
Catalog Number:
AG01ABT4
Molecular Formula:
C10H8O2S2
Molecular Weight:
224.2993
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Product Description
Catalog Number:
AG01ABT4
Chemical Name:
5-(3-methylthiophen-2-yl)thiophene-2-carboxylic acid
CAS Number:
1342606-57-8
Molecular Formula:
C10H8O2S2
Molecular Weight:
224.2993
MDL Number:
MFCD19625429
IUPAC Name:
5-(3-methylthiophen-2-yl)thiophene-2-carboxylic acid
InChI:
InChI=1S/C10H8O2S2/c1-6-4-5-13-9(6)7-2-3-8(14-7)10(11)12/h2-5H,1H3,(H,11,12)
InChI Key:
QLLMHLGYHRKAIA-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(s1)c1sccc1C
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.997g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.292g/mol
Monoisotopic Mass:
223.997g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
93.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties