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339016-79-4

339016-79-4 | 4-methoxy-2-(4-methylphenoxy)pyridine-3-carbonitrile

CAS No: 339016-79-4 Catalog No: AG00IRVG MDL No:MFCD00975472

Product Description

Catalog Number:
AG00IRVG
Chemical Name:
4-methoxy-2-(4-methylphenoxy)pyridine-3-carbonitrile
CAS Number:
339016-79-4
Molecular Formula:
C14H12N2O2
Molecular Weight:
240.2573
MDL Number:
MFCD00975472
IUPAC Name:
4-methoxy-2-(4-methylphenoxy)pyridine-3-carbonitrile
InChI:
InChI=1S/C14H12N2O2/c1-10-3-5-11(6-4-10)18-14-12(9-15)13(17-2)7-8-16-14/h3-8H,1-2H3
InChI Key:
FKFQFOQJCLFJHB-UHFFFAOYSA-N
SMILES:
N#Cc1c(nccc1OC)Oc1ccc(cc1)C

Properties

Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.09g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.262g/mol
Monoisotopic Mass:
240.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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

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