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Home Other Building Blocks Dibenzo[b,f][1,4]oxazepin-11(10h)-one

Dibenzo[b,f][1,4]oxazepin-11(10h)-one

CAS No.:
3158-85-8
Catalog Number:
AG003PBI
Molecular Formula:
C13H9NO2
Molecular Weight:
211.2161
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$63
- +
1g
95%
In Stock USA
United States
$144
- +
5g
95%
In Stock USA
United States
$425
- +
Product Description
Catalog Number:
AG003PBI
Chemical Name:
Dibenzo[b,f][1,4]oxazepin-11(10h)-one
CAS Number:
3158-85-8
Molecular Formula:
C13H9NO2
Molecular Weight:
211.2161
MDL Number:
MFCD00005074
IUPAC Name:
5H-benzo[b][1,4]benzoxazepin-6-one
InChI:
InChI=1S/C13H9NO2/c15-13-9-5-1-3-7-11(9)16-12-8-4-2-6-10(12)14-13/h1-8H,(H,14,15)
InChI Key:
OXMPDOZBQGHTGH-UHFFFAOYSA-N
SMILES:
O=C1Nc2ccccc2Oc2c1cccc2
EC Number:
221-601-6
UNII:
11B50BX482
NSC Number:
140824
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.063g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.22g/mol
Monoisotopic Mass:
211.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
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
Novel non-nucleoside inhibitors of HIV-1 reverse transcriptase. 2. Tricyclic pyridobenzoxazepinones and dibenzoxazepinones. Journal of medicinal chemistry 19920515
Properties