Home Nitros 1-(2-methyl-2-nitro-propyl)-4-nitro-benzene

1-(2-methyl-2-nitro-propyl)-4-nitro-benzene

CAS No.:
5440-67-5
Catalog Number:
AG00E0YM
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$98
- +
5g
1 week
United States
$274
- +
10g
1 week
United States
$416
- +
25g
1 week
United States
$792
- +
Product Description
Catalog Number:
AG00E0YM
Chemical Name:
1-(2-methyl-2-nitro-propyl)-4-nitro-benzene
CAS Number:
5440-67-5
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
MDL Number:
MFCD00024810
IUPAC Name:
1-(2-methyl-2-nitropropyl)-4-nitrobenzene
InChI:
InChI=1S/C10H12N2O4/c1-10(2,12(15)16)7-8-3-5-9(6-4-8)11(13)14/h3-6H,7H2,1-2H3
InChI Key:
RYQDSPKQTUQTND-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)CC([N+](=O)[O-])(C)C
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.08g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.216g/mol
Monoisotopic Mass:
224.08g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties