Home Bromides 1020720-09-5
1020720-09-5,MFCD06658745
Catalog No.:AA0006HD
1020720-09-5 | Benzene-1,2,3,4-d4, 5-bromo-6-nitro-
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250mg
1 week  
$1,697.00   $1,188.00
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500mg
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$2,974.00   $2,082.00
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Technical Information
Catalog Number:
AA0006HD
Chemical Name:
Benzene-1,2,3,4-d4, 5-bromo-6-nitro-
CAS Number:
1020720-09-5
Molecular Formula:
C6BrD4NO2
Molecular Weight:
206.0301
MDL Number:
MFCD06658745
IUPAC Name:
1-bromo-2,3,4,5-tetradeuterio-6-nitrobenzene
InChI:
InChI=1S/C6H4BrNO2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H/i1D,2D,3D,4D
InChI Key:
ORPVVAKYSXQCJI-RHQRLBAQSA-N
SMILES:
c1([2H])c([2H])c([2H])c(c(c1[2H])[N+](=O)[O-])Br
Properties
Computed Properties
 
Complexity:
134  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.968g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
4  
Molecular Weight:
206.031g/mol
Monoisotopic Mass:
204.968g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

Synonyms
 
1-Bromo-2-nitrobenze-d4 
1020720-09-5 
AKOS030254298 
FT-0663810 
J-000621 
1-Bromo-2-nitrobenzene-d4, 98 atom % D, 98% (CP) 
CS-T-49841 
1-Bromo-2-nitro(~2~H_4_)benzene 
2-Bromonitrobenzene-d4 
2-Nitrobromobenzene-d4 
2-Nitrophenyl-d4 Bromide 
1-Bromo-2-nitrobenzene-d4 
CTK8F3267 
DTXSID70661829 
NSC 403836-d4 
Literature
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