Home Carboxys 2-Thiophenecarboxylicacid, 5-(4-pyridinyl)-

2-Thiophenecarboxylicacid, 5-(4-pyridinyl)-

CAS No.:
216867-32-2
Catalog Number:
AG007PGG
Molecular Formula:
C10H7NO2S
Molecular Weight:
205.2331
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Product Description
Catalog Number:
AG007PGG
Chemical Name:
2-Thiophenecarboxylicacid, 5-(4-pyridinyl)-
CAS Number:
216867-32-2
Molecular Formula:
C10H7NO2S
Molecular Weight:
205.2331
MDL Number:
MFCD07376007
IUPAC Name:
5-pyridin-4-ylthiophene-2-carboxylic acid
InChI:
InChI=1S/C10H7NO2S/c12-10(13)9-2-1-8(14-9)7-3-5-11-6-4-7/h1-6H,(H,12,13)
InChI Key:
OJOWGMLSJKRJNV-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(s1)c1ccncc1
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.02g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.231g/mol
Monoisotopic Mass:
205.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties