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Home > Pyridines > 691398-44-4
691398-44-4 | (2Z)-6-hydroxy-2-(pyridin-2-ylmethylene)-1-benzofuran-3(2H)-one
CAS No: 691398-44-4 Catalog No: AG00JDRZ MDL No:MFCD09259089
Product Description
Catalog Number:
AG00JDRZ
Chemical Name:
(2Z)-6-hydroxy-2-(pyridin-2-ylmethylene)-1-benzofuran-3(2H)-one
CAS Number:
691398-44-4
Molecular Formula:
C14H9NO3
Molecular Weight:
239.2262
MDL Number:
MFCD09259089
IUPAC Name:
(2Z)-6-hydroxy-2-(pyridin-2-ylmethylidene)-1-benzofuran-3-one
InChI:
InChI=1S/C14H9NO3/c16-10-4-5-11-12(8-10)18-13(14(11)17)7-9-3-1-2-6-15-9/h1-8,16H/b13-7-
InChI Key:
ZPLWADJKSRNLQP-QPEQYQDCSA-N
SMILES:
Oc1ccc2c(c1)O/C(=C\c1ccccn1)/C2=O
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
239.058g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.23g/mol
Monoisotopic Mass:
239.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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