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868755-62-8 | 2-Thiophenecarboxylicacid, 5-(2-furanyl)-
CAS No: 868755-62-8 Catalog No: AG004IC7 MDL No:MFCD05885497
Product Description
Catalog Number:
AG004IC7
Chemical Name:
2-Thiophenecarboxylicacid, 5-(2-furanyl)-
CAS Number:
868755-62-8
Molecular Formula:
C9H6O3S
Molecular Weight:
194.2071
MDL Number:
MFCD05885497
IUPAC Name:
5-(furan-2-yl)thiophene-2-carboxylic acid
InChI:
InChI=1S/C9H6O3S/c10-9(11)8-4-3-7(13-8)6-2-1-5-12-6/h1-5H,(H,10,11)
InChI Key:
ZASUJVQPFQRFPQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(s1)c1ccco1
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.004g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.204g/mol
Monoisotopic Mass:
194.004g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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