Home Halogens 2,6-dibromo-2,3-dihydro-1H-inden-1-one

2,6-dibromo-2,3-dihydro-1H-inden-1-one

CAS No.:
1188141-94-7
Catalog Number:
AG01C1OD
Molecular Formula:
C9H6Br2O
Molecular Weight:
289.9513
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Product Description
Catalog Number:
AG01C1OD
Chemical Name:
2,6-dibromo-2,3-dihydro-1H-inden-1-one
CAS Number:
1188141-94-7
Molecular Formula:
C9H6Br2O
Molecular Weight:
289.9513
MDL Number:
MFCD11219379
IUPAC Name:
2,6-dibromo-2,3-dihydroinden-1-one
InChI:
InChI=1S/C9H6Br2O/c10-6-2-1-5-3-8(11)9(12)7(5)4-6/h1-2,4,8H,3H2
InChI Key:
KZYIZXUHEKUDQW-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)C(=O)C(C2)Br
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.876g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.954g/mol
Monoisotopic Mass:
287.879g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties