Home Nitros 1-(4-Methyl-2-nitrophenyl)ethanone

1-(4-Methyl-2-nitrophenyl)ethanone

CAS No.:
155694-84-1
Catalog Number:
AG001O3W
Molecular Formula:
C9H9NO3
Molecular Weight:
179.1727
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$120
- +
1g
97%
1 week
United States
$246
- +
Product Description
Catalog Number:
AG001O3W
Chemical Name:
1-(4-Methyl-2-nitrophenyl)ethanone
CAS Number:
155694-84-1
Molecular Formula:
C9H9NO3
Molecular Weight:
179.1727
MDL Number:
MFCD22573024
IUPAC Name:
1-(4-methyl-2-nitrophenyl)ethanone
InChI:
InChI=1S/C9H9NO3/c1-6-3-4-8(7(2)11)9(5-6)10(12)13/h3-5H,1-2H3
InChI Key:
UPVDTZDVDGTUEP-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)[N+](=O)[O-])C(=O)C
Properties
Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.058g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.175g/mol
Monoisotopic Mass:
179.058g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties