Home Other Building Blocks 3-Fluoroisatoic anhydride

3-Fluoroisatoic anhydride

CAS No.:
174463-53-7
Catalog Number:
AG001ZNW
Molecular Formula:
C8H4FNO3
Molecular Weight:
181.1207
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$769
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Product Description
Catalog Number:
AG001ZNW
Chemical Name:
3-Fluoroisatoic anhydride
CAS Number:
174463-53-7
Molecular Formula:
C8H4FNO3
Molecular Weight:
181.1207
MDL Number:
MFCD06796569
IUPAC Name:
8-fluoro-1H-3,1-benzoxazine-2,4-dione
InChI:
InChI=1S/C8H4FNO3/c9-5-3-1-2-4-6(5)10-8(12)13-7(4)11/h1-3H,(H,10,12)
InChI Key:
IERJBARKMJORGI-UHFFFAOYSA-N
SMILES:
O=c1oc(=O)c2c([nH]1)c(F)ccc2
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.018g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.122g/mol
Monoisotopic Mass:
181.018g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties