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159639-61-9

159639-61-9 | 1(2H)-Naphthalenone, 5,7-dibromo-3,4-dihydro-

CAS No: 159639-61-9 Catalog No: AG001R96 MDL No:MFCD09752947

Product Description

Catalog Number:
AG001R96
Chemical Name:
1(2H)-Naphthalenone, 5,7-dibromo-3,4-dihydro-
CAS Number:
159639-61-9
Molecular Formula:
C10H8Br2O
Molecular Weight:
303.9779
MDL Number:
MFCD09752947
IUPAC Name:
5,7-dibromo-3,4-dihydro-2H-naphthalen-1-one
InChI:
InChI=1S/C10H8Br2O/c11-6-4-8-7(9(12)5-6)2-1-3-10(8)13/h4-5H,1-3H2
InChI Key:
MVSWWAWOOVHMMV-UHFFFAOYSA-N
SMILES:
Brc1cc(Br)c2c(c1)C(=O)CCC2

Properties

Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.892g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.981g/mol
Monoisotopic Mass:
301.894g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

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