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Home Other Building Blocks 2-Bromo-1-(pyren-1-yl)ethanone

2-Bromo-1-(pyren-1-yl)ethanone

CAS No.:
80480-15-5
Catalog Number:
AG003D2I
Molecular Formula:
C18H11BrO
Molecular Weight:
323.1833
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$164
- +
Product Description
Catalog Number:
AG003D2I
Chemical Name:
2-Bromo-1-(pyren-1-yl)ethanone
CAS Number:
80480-15-5
Molecular Formula:
C18H11BrO
Molecular Weight:
323.1833
MDL Number:
MFCD00191839
IUPAC Name:
2-bromo-1-pyren-1-ylethanone
InChI:
InChI=1S/C18H11BrO/c19-10-16(20)14-8-6-13-5-4-11-2-1-3-12-7-9-15(14)18(13)17(11)12/h1-9H,10H2
InChI Key:
KAEDEGFCOPIKKM-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1ccc2c3c1ccc1c3c(cc2)ccc1
Properties
Complexity:
393  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.999g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.189g/mol
Monoisotopic Mass:
321.999g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5  
Literature
Title Journal
Detection of okadaic acid and related esters in mussels during diarrhetic shellfish poisoning (DSP) episodes in Greece using the mouse bioassay, the PP2A inhibition assay and HPLC with fluorimetric detection. Toxicon : official journal of the International Society on Toxinology 20090201
Determination of dialkyl phosphates as breakdown products of organophosphorus insecticides in fruit juices by HPTLC with fluorescence detection. Journal of AOAC International 20090101
Properties