Home Nitros 6-fluoro-8-nitro-3,4-dihydro-2H-1-benzopyran-4-one

6-fluoro-8-nitro-3,4-dihydro-2H-1-benzopyran-4-one

CAS No.:
258528-35-7
Catalog Number:
AG01A6SA
Molecular Formula:
C9H6FNO4
Molecular Weight:
211.1466
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Product Description
Catalog Number:
AG01A6SA
Chemical Name:
6-fluoro-8-nitro-3,4-dihydro-2H-1-benzopyran-4-one
CAS Number:
258528-35-7
Molecular Formula:
C9H6FNO4
Molecular Weight:
211.1466
MDL Number:
MFCD11518437
IUPAC Name:
6-fluoro-8-nitro-2,3-dihydrochromen-4-one
InChI:
InChI=1S/C9H6FNO4/c10-5-3-6-8(12)1-2-15-9(6)7(4-5)11(13)14/h3-4H,1-2H2
InChI Key:
GQTVYGLTUVIQTG-UHFFFAOYSA-N
SMILES:
Fc1cc([N+](=O)[O-])c2c(c1)C(=O)CCO2
Properties
Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.028g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.148g/mol
Monoisotopic Mass:
211.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties