Home Bromides 221030-81-5
221030-81-5,MFCD29479643
Catalog No.:AA01AFKT
221030-81-5 | 4,5-dibromo-2-(2,2,2-trifluoroethyl)-2,3-dihydropyridazin-3-one
Pack Size
Purity
Availability
Price(USD)
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100mg
95.0%
3 weeks  
$554.00
- +
250mg
95.0%
3 weeks  
$778.00
- +
500mg
95.0%
3 weeks  
$1,210.00
- +
1g
95.0%
3 weeks  
$1,544.00
- +
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Technical Information
Catalog Number:
AA01AFKT
Chemical Name:
4,5-dibromo-2-(2,2,2-trifluoroethyl)-2,3-dihydropyridazin-3-one
CAS Number:
221030-81-5
Molecular Formula:
C6H3Br2F3N2O
Molecular Weight:
335.9040
MDL Number:
MFCD29479643
IUPAC Name:
4,5-dibromo-2-(2,2,2-trifluoroethyl)pyridazin-3-one
InChI:
InChI=1S/C6H3Br2F3N2O/c7-3-1-12-13(2-6(9,10)11)5(14)4(3)8/h1H,2H2
InChI Key:
VYDCNWDRQPFXRR-UHFFFAOYSA-N
SMILES:
FC(Cn1ncc(c(c1=O)Br)Br)(F)F
Properties
Computed Properties
 
Complexity:
324  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.854g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
335.906g/mol
Monoisotopic Mass:
333.856g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

Synonyms
 
221030-81-5 
4,5-dibromo-2-(2,2,2-trifluoroethyl)-2,3-dihydropyridazin-3-one 
4,5-Dibromo-2-(2,2,2-trifluoroethyl)pyridazin-3(2H)-one 
SCHEMBL4183392 
VYDCNWDRQPFXRR-UHFFFAOYSA-N 
ZINC35065507 
AKOS034186875 
Z325211670 
2-(2,2,2-trifluoroethyl)-4,5-dibromo-3(2H)-pyridazinone 
Literature
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