Home Carboxys 5-(2,3-dihydro-1-benzofuran-5-yl)pyridine-3-carboxylic acid

5-(2,3-dihydro-1-benzofuran-5-yl)pyridine-3-carboxylic acid

CAS No.:
1272838-47-7
Catalog Number:
AG01A17Z
Molecular Formula:
C14H11NO3
Molecular Weight:
241.2420
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Product Description
Catalog Number:
AG01A17Z
Chemical Name:
5-(2,3-dihydro-1-benzofuran-5-yl)pyridine-3-carboxylic acid
CAS Number:
1272838-47-7
Molecular Formula:
C14H11NO3
Molecular Weight:
241.2420
MDL Number:
MFCD16200866
IUPAC Name:
5-(2,3-dihydro-1-benzofuran-5-yl)pyridine-3-carboxylic acid
InChI:
InChI=1S/C14H11NO3/c16-14(17)12-6-11(7-15-8-12)9-1-2-13-10(5-9)3-4-18-13/h1-2,5-8H,3-4H2,(H,16,17)
InChI Key:
MWENGLGTBLDDKQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cncc(c1)c1ccc2c(c1)CCO2
Properties
Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.074g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.246g/mol
Monoisotopic Mass:
241.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties