Home Carboxys 4-formyl-2-methoxyphenyl pyridine-3-carboxylate

4-formyl-2-methoxyphenyl pyridine-3-carboxylate

CAS No.:
380431-06-1
Catalog Number:
AG00I7HM
Molecular Formula:
C14H11NO4
Molecular Weight:
257.2414
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Product Description
Catalog Number:
AG00I7HM
Chemical Name:
4-formyl-2-methoxyphenyl pyridine-3-carboxylate
CAS Number:
380431-06-1
Molecular Formula:
C14H11NO4
Molecular Weight:
257.2414
MDL Number:
MFCD03150673
IUPAC Name:
(4-formyl-2-methoxyphenyl) pyridine-3-carboxylate
InChI:
InChI=1S/C14H11NO4/c1-18-13-7-10(9-16)4-5-12(13)19-14(17)11-3-2-6-15-8-11/h2-9H,1H3
InChI Key:
NIEKGVVKLQOETF-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)ccc1OC(=O)c1cccnc1
Properties
Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.069g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.245g/mol
Monoisotopic Mass:
257.069g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties