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1218-54-8

1218-54-8 | 2H-1-Benzopyran-2-one, 3-(4-aminophenyl)-

CAS No: 1218-54-8 Catalog No: AG001624 MDL No:MFCD00297993

Product Description

Catalog Number:
AG001624
Chemical Name:
2H-1-Benzopyran-2-one, 3-(4-aminophenyl)-
CAS Number:
1218-54-8
Molecular Formula:
C15H11NO2
Molecular Weight:
237.2533
MDL Number:
MFCD00297993
IUPAC Name:
3-(4-aminophenyl)chromen-2-one
InChI:
InChI=1S/C15H11NO2/c16-12-7-5-10(6-8-12)13-9-11-3-1-2-4-14(11)18-15(13)17/h1-9H,16H2
InChI Key:
LYIBWAQRUZXFGC-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1cc2ccccc2oc1=O
NSC Number:
215992

Properties

Complexity:
356  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.079g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.258g/mol
Monoisotopic Mass:
237.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

Literature

Title Journal
Design, synthesis, and evaluation of coumarin-based molecular probes for imaging of myelination. Journal of medicinal chemistry 20110414
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
In situ fluorescence imaging of myelination. The journal of histochemistry and cytochemistry : official journal of the Histochemistry Society 20100701
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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