Home Other Building Blocks 3-Fluorodibenz[b,e]oxepin-11(6h)-one

3-Fluorodibenz[b,e]oxepin-11(6h)-one

CAS No.:
114312-48-0
Catalog Number:
AG000B22
Molecular Formula:
C14H9FO2
Molecular Weight:
228.2185
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$300
- +
1g
95%
In Stock USA
United States
$700
- +
Product Description
Catalog Number:
AG000B22
Chemical Name:
3-Fluorodibenz[b,e]oxepin-11(6h)-one
CAS Number:
114312-48-0
Molecular Formula:
C14H9FO2
Molecular Weight:
228.2185
MDL Number:
MFCD12828511
IUPAC Name:
3-fluoro-6H-benzo[c][1]benzoxepin-11-one
InChI:
InChI=1S/C14H9FO2/c15-10-5-6-12-13(7-10)17-8-9-3-1-2-4-11(9)14(12)16/h1-7H,8H2
InChI Key:
BZAIXEGWNRZEFA-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)OCc1c(C2=O)cccc1
Properties
Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.059g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.222g/mol
Monoisotopic Mass:
228.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties