Home Other Building Blocks 2-[(3-fluorophenyl)methyl]isoindole-1,3-dione

2-[(3-fluorophenyl)methyl]isoindole-1,3-dione

CAS No.:
70216-78-3
Catalog Number:
AG019ETN
Molecular Formula:
C15H10FNO2
Molecular Weight:
255.2438
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$275
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Product Description
Catalog Number:
AG019ETN
Chemical Name:
2-[(3-fluorophenyl)methyl]isoindole-1,3-dione
CAS Number:
70216-78-3
Molecular Formula:
C15H10FNO2
Molecular Weight:
255.2438
MDL Number:
MFCD05266032
IUPAC Name:
2-[(3-fluorophenyl)methyl]isoindole-1,3-dione
InChI:
InChI=1S/C15H10FNO2/c16-11-5-3-4-10(8-11)9-17-14(18)12-6-1-2-7-13(12)15(17)19/h1-8H,9H2
InChI Key:
APYCABOCKVIWAT-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)CN1C(=O)c2c(C1=O)cccc2
Properties
Complexity:
360  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.07g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.248g/mol
Monoisotopic Mass:
255.07g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties