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90284-44-9

90284-44-9 | Methanone, (1,4-dihydro-2H-3,1-benzoxazin-2-yl)phenyl-

CAS No: 90284-44-9 Catalog No: AG006GO3 MDL No:

Product Description

Catalog Number:
AG006GO3
Chemical Name:
Methanone, (1,4-dihydro-2H-3,1-benzoxazin-2-yl)phenyl-
CAS Number:
90284-44-9
Molecular Formula:
C15H13NO2
Molecular Weight:
239.2692
IUPAC Name:
2,4-dihydro-1H-3,1-benzoxazin-2-yl(phenyl)methanone
InChI:
InChI=1S/C15H13NO2/c17-14(11-6-2-1-3-7-11)15-16-13-9-5-4-8-12(13)10-18-15/h1-9,15-16H,10H2
InChI Key:
CFUWUAUHXZIICW-UHFFFAOYSA-N
SMILES:
O=C(C1OCc2c(N1)cccc2)c1ccccc1
NSC Number:
383237

Properties

Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.095g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
239.274g/mol
Monoisotopic Mass:
239.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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