Home Nitros 3-Bromo-2-nitrotoluene

3-Bromo-2-nitrotoluene

CAS No.:
52414-97-8
Catalog Number:
AG003E4B
Molecular Formula:
C7H6BrNO2
Molecular Weight:
216.0320
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$40
- +
5g
98%
In Stock USA
United States
$50
- +
10g
98%
In Stock USA
United States
$88
- +
25g
98%
In Stock USA
United States
$175
- +
100g
98%
In Stock USA
United States
$613
- +
Product Description
Catalog Number:
AG003E4B
Chemical Name:
3-Bromo-2-nitrotoluene
CAS Number:
52414-97-8
Molecular Formula:
C7H6BrNO2
Molecular Weight:
216.0320
MDL Number:
MFCD02673631
IUPAC Name:
1-bromo-3-methyl-2-nitrobenzene
InChI:
InChI=1S/C7H6BrNO2/c1-5-3-2-4-6(8)7(5)9(10)11/h2-4H,1H3
InChI Key:
XDKMDDOCVPNVMB-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(C)cccc1Br
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.958g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.034g/mol
Monoisotopic Mass:
214.958g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties