Home Nitros 4-Bromo-2-nitro-5-propoxy-N-propylaniline

4-Bromo-2-nitro-5-propoxy-N-propylaniline

CAS No.:
1311197-83-7
Catalog Number:
AG000VK0
Molecular Formula:
C12H17BrN2O3
Molecular Weight:
317.1790
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$63
- +
5g
97%
In Stock USA
United States
$188
- +
25g
97%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG000VK0
Chemical Name:
4-Bromo-2-nitro-5-propoxy-N-propylaniline
CAS Number:
1311197-83-7
Molecular Formula:
C12H17BrN2O3
Molecular Weight:
317.1790
MDL Number:
MFCD19237157
IUPAC Name:
4-bromo-2-nitro-5-propoxy-N-propylaniline
InChI:
InChI=1S/C12H17BrN2O3/c1-3-5-14-10-8-12(18-6-4-2)9(13)7-11(10)15(16)17/h7-8,14H,3-6H2,1-2H3
InChI Key:
NOBNVOVIEYJIJT-UHFFFAOYSA-N
SMILES:
CCCNc1cc(OCCC)c(cc1[N+](=O)[O-])Br
Properties
Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.042g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
317.183g/mol
Monoisotopic Mass:
316.042g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
67.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Properties