Home Bromides 1000573-87-4
1000573-87-4,MFCD09878185
Catalog No.:AA0000OF
1000573-87-4 | Benzene, 5-bromo-1-chloro-2-iodo-3-methyl-
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
1 week  
$234.00
- +
1g
97%
1 week  
$428.00
- +
5g
97%
1 week  
$1,205.00
- +
25g
97%
1 week  
$3,528.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0000OF
Chemical Name:
Benzene, 5-bromo-1-chloro-2-iodo-3-methyl-
CAS Number:
1000573-87-4
Molecular Formula:
C7H5BrClI
Molecular Weight:
331.3761
MDL Number:
MFCD09878185
IUPAC Name:
5-bromo-1-chloro-2-iodo-3-methylbenzene
InChI:
InChI=1S/C7H5BrClI/c1-4-2-5(8)3-6(9)7(4)10/h2-3H,1H3
InChI Key:
NUXOMLHLSLRWMX-UHFFFAOYSA-N
SMILES:
Brc1cc(C)c(c(c1)Cl)I
Properties
Computed Properties
 
Complexity:
120  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.831g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.375g/mol
Monoisotopic Mass:
329.831g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  

Synonyms
 
5-Bromo-3-chloro-2-iodotoluene 
1000573-87-4 
Benzene, 5-bromo-1-chloro-2-iodo-3-methyl- 
Q-7421 
C7H5BrClI 
5-bromo-1-chloro-2-iodo-3-methylbenzene 
DTXSID10661545 
MFCD09878185 
ZINC63339652 
AKOS027257549 
FCH1394699 
AX8277814 
Y3493 
Literature
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