Home Nitros 2-Bromo-1,3-dimethyl-4-nitrobenzene

2-Bromo-1,3-dimethyl-4-nitrobenzene

CAS No.:
60956-25-4
Catalog Number:
AG00ELFH
Molecular Formula:
C8H8BrNO2
Molecular Weight:
230.0586
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$194
- +
5g
95%
1 week
United States
$399
- +
Product Description
Catalog Number:
AG00ELFH
Chemical Name:
2-Bromo-1,3-dimethyl-4-nitrobenzene
CAS Number:
60956-25-4
Molecular Formula:
C8H8BrNO2
Molecular Weight:
230.0586
MDL Number:
MFCD11878621
IUPAC Name:
2-bromo-1,3-dimethyl-4-nitrobenzene
InChI:
InChI=1S/C8H8BrNO2/c1-5-3-4-7(10(11)12)6(2)8(5)9/h3-4H,1-2H3
InChI Key:
KHZIUZUDLBDCMN-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(c1C)Br)C
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.974g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.061g/mol
Monoisotopic Mass:
228.974g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties