Home Bromides 101580-70-5
101580-70-5,MFCD23135744
Catalog No.:AA0004RX
101580-70-5 | 1,2-Dibromo-4-methyl-5-nitrobenzene
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100mg
95%
in stock  
$14.00   $10.00
- +
250mg
95%
in stock  
$19.00   $13.00
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1g
95%
in stock  
$30.00   $21.00
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  • Technical Information
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Technical Information
Catalog Number:
AA0004RX
Chemical Name:
1,2-Dibromo-4-methyl-5-nitrobenzene
CAS Number:
101580-70-5
Molecular Formula:
C7H5Br2NO2
Molecular Weight:
294.9281
MDL Number:
MFCD23135744
IUPAC Name:
1,2-dibromo-4-methyl-5-nitrobenzene
InChI:
InChI=1S/C7H5Br2NO2/c1-4-2-5(8)6(9)3-7(4)10(11)12/h2-3H,1H3
InChI Key:
OJFOMLFOBYEZNH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(Br)c(cc1C)Br
EC Number:
600-228-6
Properties
Computed Properties
 
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.867g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.93g/mol
Monoisotopic Mass:
292.869g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

Synonyms
 
1,2-Dibromo-4-methyl-5-nitrobenzene 
101580-70-5 
ANW-70086 
MFCD23135744 
ZINC82046747 
AKOS016001619 
DS-3565 
AK100606 
AJ-124442 
TC-158831 
4CH-012213 
ST24020923 
Benzene, 1,2-dibromo-4-methyl-5-nitro- 
Y5847 
C7H5Br2NO2 
ACMC-20aes8 
4,5-Dibromo-2-nitrotoluene 
SCHEMBL2442735 
CTK0G8098 
KS-00000QUP 
DTXSID20726275 
OJFOMLFOBYEZNH-UHFFFAOYSA-N 
Literature
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