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1785-04-2

1785-04-2 | 9H-Fluoren-9-one, 2,7-dibromo-4-nitro-

CAS No: 1785-04-2 Catalog No: AG00263U MDL No:

Product Description

Catalog Number:
AG00263U
Chemical Name:
9H-Fluoren-9-one, 2,7-dibromo-4-nitro-
CAS Number:
1785-04-2
Molecular Formula:
C13H5Br2NO3
Molecular Weight:
382.9917
IUPAC Name:
2,7-dibromo-4-nitrofluoren-9-one
InChI:
InChI=1S/C13H5Br2NO3/c14-6-1-2-8-9(3-6)13(17)10-4-7(15)5-11(12(8)10)16(18)19/h1-5H
InChI Key:
PUTIIWOMKYLKOX-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)C(=O)c1c2c(cc(c1)Br)[N+](=O)[O-]
NSC Number:
90689

Properties

Complexity:
411  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.862g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
382.995g/mol
Monoisotopic Mass:
380.864g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  

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