sales@angenesci.com
Login | Register
logo
Structures Search
Home Nitros 3-Bromo-4-methyl-5-nitro-2-pyridinone

3-Bromo-4-methyl-5-nitro-2-pyridinone

CAS No.:
1049706-72-0
Catalog Number:
AG003J29
Molecular Formula:
C6H5BrN2O3
Molecular Weight:
233.0195
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$119
- +
5g
95%
In Stock USA
United States
$369
- +
Product Description
Catalog Number:
AG003J29
Chemical Name:
3-Bromo-4-methyl-5-nitro-2-pyridinone
CAS Number:
1049706-72-0
Molecular Formula:
C6H5BrN2O3
Molecular Weight:
233.0195
MDL Number:
MFCD12828179
IUPAC Name:
3-bromo-4-methyl-5-nitro-1H-pyridin-2-one
InChI:
InChI=1S/C6H5BrN2O3/c1-3-4(9(11)12)2-8-6(10)5(3)7/h2H,1H3,(H,8,10)
InChI Key:
JJTIUCLTXGGQCH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c[nH]c(=O)c(c1C)Br
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.948g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.021g/mol
Monoisotopic Mass:
231.948g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties