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1261896-15-4 | 2-Thiophenecarboxylic acid, 4-(2-hydroxyphenyl)-
CAS No: 1261896-15-4 Catalog No: AG000S3Q MDL No:MFCD18312887
Product Description
Catalog Number:
AG000S3Q
Chemical Name:
2-Thiophenecarboxylic acid, 4-(2-hydroxyphenyl)-
CAS Number:
1261896-15-4
Molecular Formula:
C11H8O3S
Molecular Weight:
220.2444
MDL Number:
MFCD18312887
IUPAC Name:
4-(2-hydroxyphenyl)thiophene-2-carboxylic acid
InChI:
InChI=1S/C11H8O3S/c12-9-4-2-1-3-8(9)7-5-10(11(13)14)15-6-7/h1-6,12H,(H,13,14)
InChI Key:
NAEFBFBTJJDWFC-UHFFFAOYSA-N
SMILES:
Oc1ccccc1c1csc(c1)C(=O)O
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.019g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.242g/mol
Monoisotopic Mass:
220.019g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
85.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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