Home Halogens 5-bromo-6-nitro-2,3-dihydro-1H-inden-1-one

5-bromo-6-nitro-2,3-dihydro-1H-inden-1-one

CAS No.:
723760-74-5
Catalog Number:
AG00FEOM
Molecular Formula:
C9H6BrNO3
Molecular Weight:
256.0528
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Product Description
Catalog Number:
AG00FEOM
Chemical Name:
5-bromo-6-nitro-2,3-dihydro-1H-inden-1-one
CAS Number:
723760-74-5
Molecular Formula:
C9H6BrNO3
Molecular Weight:
256.0528
MDL Number:
MFCD16249551
IUPAC Name:
5-bromo-6-nitro-2,3-dihydroinden-1-one
InChI:
InChI=1S/C9H6BrNO3/c10-7-3-5-1-2-9(12)6(5)4-8(7)11(13)14/h3-4H,1-2H2
InChI Key:
MUTOBVAOAKQKMD-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2C(=O)CCc2cc1Br
Properties
Complexity:
276  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.953g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.055g/mol
Monoisotopic Mass:
254.953g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties