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2008-76-6 | 1(2H)-Acenaphthylenone, 2,2-dibromo-
CAS No: 2008-76-6 Catalog No: AG002D0Z MDL No:
Product Description
Catalog Number:
AG002D0Z
Chemical Name:
1(2H)-Acenaphthylenone, 2,2-dibromo-
CAS Number:
2008-76-6
Molecular Formula:
C12H6Br2O
Molecular Weight:
325.9834
IUPAC Name:
2,2-dibromoacenaphthylen-1-one
InChI:
InChI=1S/C12H6Br2O/c13-12(14)9-6-2-4-7-3-1-5-8(10(7)9)11(12)15/h1-6H
InChI Key:
SETLCWZOTOAKNH-UHFFFAOYSA-N
SMILES:
O=C1c2cccc3c2c(C1(Br)Br)ccc3
NSC Number:
128359
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.876g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.987g/mol
Monoisotopic Mass:
323.879g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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