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1092306-23-4 | 5-(5-methylfuran-2-yl)thiophene-2-carboxylic acid
CAS No: 1092306-23-4 Catalog No: AG01A5RI MDL No:MFCD07376000
Product Description
Catalog Number:
AG01A5RI
Chemical Name:
5-(5-methylfuran-2-yl)thiophene-2-carboxylic acid
CAS Number:
1092306-23-4
Molecular Formula:
C10H8O3S
Molecular Weight:
208.2337
MDL Number:
MFCD07376000
IUPAC Name:
5-(5-methylfuran-2-yl)thiophene-2-carboxylic acid
InChI:
InChI=1S/C10H8O3S/c1-6-2-3-7(13-6)8-4-5-9(14-8)10(11)12/h2-5H,1H3,(H,11,12)
InChI Key:
JSMYBMVEUSDVSN-UHFFFAOYSA-N
SMILES:
Cc1ccc(o1)c1ccc(s1)C(=O)O
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.019g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.231g/mol
Monoisotopic Mass:
208.019g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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