Home Halogens 2-Chloro-3-bromo-5-nitrotoluene

2-Chloro-3-bromo-5-nitrotoluene

CAS No.:
116277-60-2
Catalog Number:
AG00JJL2
Molecular Formula:
C7H5BrClNO2
Molecular Weight:
250.4771
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$149
- +
1g
95%
1 week
United States
$264
- +
5g
95%
1 week
United States
$717
- +
25g
95%
1 week
United States
$2075
- +
Product Description
Catalog Number:
AG00JJL2
Chemical Name:
2-Chloro-3-bromo-5-nitrotoluene
CAS Number:
116277-60-2
Molecular Formula:
C7H5BrClNO2
Molecular Weight:
250.4771
MDL Number:
MFCD11846020
IUPAC Name:
1-bromo-2-chloro-3-methyl-5-nitrobenzene
InChI:
InChI=1S/C7H5BrClNO2/c1-4-2-5(10(11)12)3-6(8)7(4)9/h2-3H,1H3
InChI Key:
ALRMZVIRRGMVRF-UHFFFAOYSA-N
SMILES:
Cc1cc(cc(c1Cl)Br)[N+](=O)[O-]
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.919g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.476g/mol
Monoisotopic Mass:
248.919g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties